Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(1H-1,2,3-triazol-5-ylsulfanyl)acetamide

Catalog ID
STK243243
SMILES N#Cc1c(NC(=O)CSc2cnn[nH]2)sc2c1CCCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H13N5OS2 MW 319.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N5OS2/c14-5-9-8-3-1-2-4-10(8)21-13(9)16-11(19)7-20-12-6-15-18-17-12/h6H,1-4,7H2,(H,16,19)(H,15,17,18)
InChIKey
BOTXBJAKCPNLOV-UHFFFAOYSA-N
Synonyms
879027-08-4
879027084
C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NNN=C3)C#N
InChI=1SC13H13N5OS2c14598312410(8)2113(9)1611(19)72012615181712h6H147H2(H1619)(H151718)
MFCD07402027
N#Cc1c(NC(=O)CSc2cnn(nH)2)sc2c1CCCC2
N(3cyano4567tetrahydro1benzothiophen2yl)2(1H123triazol5ylsulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2(2Htriazol4ylsulfanyl)acetamide
ZINC000004945296
ZINC04945296
ZINC4945296

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Available files

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