Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate
Catalog ID
STK808634
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)C(C)(C)C)sc(c1C)C(=O)Nc1ccccc1
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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 C28H30N2O4S MW 490.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O4S/c1-6-34-27(33)23-18(2)24(25(32)29-21-10-8-7-9-11-21)35-26(23)30-22(31)17-14-19-12-15-20(16-13-19)28(3,4)5/h7-17H,6H2,1-5H3,(H,29,32)(H,30,31)/b17-14+InChIKey
KOHTZRHMUIVFRN-SAPNQHFASA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)C=CC3=CC=C(C=C3)C(C)(C)C
CCOC(=O)c1c(NC(=O)C=Cc2ccc(cc2)C(C)(C)C)sc(c1C)C(=O)Nc1ccccc1
ethyl2(((2E)3(4tertbutylphenyl)prop2enoyl)amino)4methyl5(phenylcarbamoyl)thiophene3carboxylate
ETHYL2(((E)3(4TERTBUTYLPHENYL)PROP2ENOYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC28H30N2O4Sc163427(33)2318(2)24(25(32)2921108791121)3526(23)3022(31)171419121520(161319)28(34)5h717H6H215H3(H2932)(H3031)b1714+
MFCD02673477
ZINC000002707271
ZINC02707271
ZINC2707271
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