Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK699475
SMILES N#Cc1c(NC(=O)CSc2nnc([nH]2)c2ccncc2)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 C18H16N6OS2 MW 396.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N6OS2/c19-9-13-12-3-1-2-4-14(12)27-17(13)21-15(25)10-26-18-22-16(23-24-18)11-5-7-20-8-6-11/h5-8H,1-4,10H2,(H,21,25)(H,22,23,24)InChIKey
OQFOQEFORBIGPC-UHFFFAOYSA-NSynonyms
586990-63-8586990638
C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NNC(=N3)C4=CC=NC=C4)C#N
InChI=1SC18H16N6OS2c1991312312414(12)2717(13)2115(25)1026182216(232418)1157208611h58H1410H2(H2125)(H222324)
MFCD04031165
N#Cc1c(NC(=O)CSc2nnc((nH)2)c2ccncc2)sc2c1CCCC2
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5pyridin4yl1H124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydrobenzo(b)thiophen2yl)2((5(pyridin4yl)4H124triazol3yl)thio)acetamide
ZINC000006133662
ZINC06133662
ZINC6133662
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