Screening compound: HCTOCKJIYGRUDP-UHFFFAOYSA-N

Screening compound: HCTOCKJIYGRUDP-UHFFFAOYSA-N
Screening compound: HCTOCKJIYGRUDP-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
HCTOCKJIYGRUDP-UHFFFAOYSA-N

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8001-8110

Molecular Formula

C13H13N7O2S (C13 H13 N7 O2 S)

Compound Name

2-{[(E)-1-methyl-2-(5-nitro-2H-1,2,3,4-tetraazol-2-yl)ethylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophen-3-yl cyanide

IUPAC name

2-[(E)-[1-(5-nitro-2H-1234-tetrazol-2-yl)propan-2-ylidene]amino]-4567-tetrahydro-1-benzothiophene-3-carbonitrile

SMILES

C/C(/Cn1nnc([N+]([O-])=O)n1)=N\c(sc1c2CCCC1)c2C#N

InChI

InChI=1S/C13H13N7O2S/c1-8(7-19-17-13(16-18-19)20(21)22)15-12-10(6-14)9-4-2-3-5-11(9)23-12/h2-5,7H2,1H3

InChI Key

HCTOCKJIYGRUDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00732288

HCTOCKJIYGRUDP-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with HCTOCKJIYGRUDP-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound HCTOCKJIYGRUDP-UHFFFAOYSA-N?
Check Price and Availability of HCTOCKJIYGRUDP-UHFFFAOYSA-N, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of HCTOCKJIYGRUDP-UHFFFAOYSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for HCTOCKJIYGRUDP-UHFFFAOYSA-N
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for HCTOCKJIYGRUDP-UHFFFAOYSA-N
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of HCTOCKJIYGRUDP-UHFFFAOYSA-N available by request