Vitas-M small molecule compound
4-{[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK400392
SMILES CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)CCC(=O)O)(C)C
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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 C18H24N2O3S MW 348.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O3S/c1-4-18(2,3)11-5-6-12-13(10-19)17(24-14(12)9-11)20-15(21)7-8-16(22)23/h11H,4-9H2,1-3H3,(H,20,21)(H,22,23)InChIKey
FGHXNFBPYOOMGF-UHFFFAOYSA-NSynonyms
4((3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC(=O)O
InChI=1SC18H24N2O3Sc1418(23)11561213(1019)17(2414(12)911)2015(21)7816(22)23h11H49H213H3(H2021)(H2223)
MFCD01353421
ZINC000004646577
ZINC000004646578
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