Vitas-M small molecule compound
4-{[4-(4-fluorophenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK471724
SMILES COC(=O)c1c(NC(=O)CCC(=O)O)sc(c1c1ccc(cc1)F)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 C17H16FNO5S MW 365.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FNO5S/c1-9-14(10-3-5-11(18)6-4-10)15(17(23)24-2)16(25-9)19-12(20)7-8-13(21)22/h3-6H,7-8H2,1-2H3,(H,19,20)(H,21,22)InChIKey
VXFACWXNMXXXGD-UHFFFAOYSA-NSynonyms
3(N(4(4FLUOROPHENYL)3(METHOXYCARBONYL)5METHYL2THIENYL)CARBAMOYL)PROPANOICACID
4((4(4fluorophenyl)3(methoxycarbonyl)5methylthiophen2yl)amino)4oxobutanoicacid
4((4(4fluorophenyl)3methoxycarbonyl5methylthiophen2yl)amino)4oxobutanoicacid
CC1=C(C(=C(S1)NC(=O)CCC(=O)O)C(=O)OC)C2=CC=C(C=C2)F
InChI=1SC17H16FNO5Sc1914(103511(18)6410)15(17(23)242)16(259)1912(20)7813(21)22h36H78H212H3(H1920)(H2122)
MFCD02255246
ZINC000006184231
ZINC6184231
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