Vitas-M small molecule compound
2-(1H-benzimidazol-2-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanamide
Catalog ID
STK757460
SMILES CCC(C(=O)Nc1sc2c(c1C#N)CCCC2)Sc1nc2c([nH]1)cccc2
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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 C20H20N4OS2 MW 396.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS2/c1-2-16(27-20-22-14-8-4-5-9-15(14)23-20)18(25)24-19-13(11-21)12-7-3-6-10-17(12)26-19/h4-5,8-9,16H,2-3,6-7,10H2,1H3,(H,22,23)(H,24,25)InChIKey
LLQWFSAZUSPPDP-UHFFFAOYSA-NSynonyms
2(1Hbenzimidazol2ylsulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)butanamide
CCC(C(=O)NC1=C(C2=C(S1)CCCC2)C#N)SC3=NC4=CC=CC=C4N3
CCC(C(=O)Nc1sc2c(c1C#N)CCCC2)Sc1nc2c((nH)1)cccc2
InChI=1SC20H20N4OS2c1216(27202214845915(14)2320)18(25)241913(1121)127361017(12)2619h458916H236710H21H3(H2223)(H2425)
MFCD01305969
ZINC000001023195
ZINC000001023196
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