Vitas-M small molecule compound
4-{[4-(4-ethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK471723
SMILES COC(=O)c1c(NC(=O)CCC(=O)O)sc(c1c1ccc(cc1)CC)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-4-12-5-7-13(8-6-12)16-11(2)26-18(17(16)19(24)25-3)20-14(21)9-10-15(22)23/h5-8H,4,9-10H2,1-3H3,(H,20,21)(H,22,23)InChIKey
UIQTZOKMWHKKNR-UHFFFAOYSA-NSynonyms
3(N(4(4ETHYLPHENYL)3(METHOXYCARBONYL)5METHYL2THIENYL)CARBAMOYL)PROPANOICACID
4((4(4ethylphenyl)3(methoxycarbonyl)5methylthiophen2yl)amino)4oxobutanoicacid
4((4(4ethylphenyl)3methoxycarbonyl5methylthiophen2yl)amino)4oxobutanoicacid
CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCC(=O)O)C
InChI=1SC19H21NO5Sc14125713(8612)1611(2)2618(17(16)19(24)253)2014(21)91015(22)23h58H4910H213H3(H2021)(H2223)
MFCD02255203
ZINC000005954399
ZINC5954399
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