Vitas-M small molecule compound
4-{[3-(cyclopropylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK470877
SMILES CC1CCc2c(C1)sc(c2C(=O)NC1CC1)NC(=O)CCC(=O)O
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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 C17H22N2O4S MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O4S/c1-9-2-5-11-12(8-9)24-17(19-13(20)6-7-14(21)22)15(11)16(23)18-10-3-4-10/h9-10H,2-8H2,1H3,(H,18,23)(H,19,20)(H,21,22)InChIKey
JECAMYWEUHYMDE-UHFFFAOYSA-NSynonyms
4((3(cyclopropylcarbamoyl)6methyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC1CCC2=C(C1)SC(=C2C(=O)NC3CC3)NC(=O)CCC(=O)O
InChI=1SC17H22N2O4Sc19251112(89)2417(1913(20)6714(21)22)15(11)16(23)18103410h910H28H21H3(H1823)(H1920)(H2122)
MFCD06021762
ZINC000006731028
ZINC000006731029
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