Vitas-M small molecule compound
4-{[4-(3,4-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK423375
SMILES COC(=O)c1c(NC(=O)CCC(=O)O)sc(c1c1ccc(c(c1)C)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-10-5-6-13(9-11(10)2)16-12(3)26-18(17(16)19(24)25-4)20-14(21)7-8-15(22)23/h5-6,9H,7-8H2,1-4H3,(H,20,21)(H,22,23)InChIKey
HWBJNQRUKCXFGH-UHFFFAOYSA-NSynonyms
3(N(4(34DIMETHYLPHENYL)3(METHOXYCARBONYL)5METHYL2THIENYL)CARBAMOYL)PROPANOICACID
4((4(34dimethylphenyl)3(methoxycarbonyl)5methylthiophen2yl)amino)4oxobutanoicacid
4((4(34DIMETHYLPHENYL)3METHOXYCARBONYL5METHYLTHIOPHEN2YL)AMINO)4OXOBUTANOICACID
CC1=C(C=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)CCC(=O)O)C)C
InChI=1SC19H21NO5Sc1105613(911(10)2)1612(3)2618(17(16)19(24)254)2014(21)7815(22)23h569H78H214H3(H2021)(H2223)
MFCD02176091
ZINC000003864301
ZINC3864301
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