Vitas-M small molecule compound
ethyl (5Z)-5-{[2,5-dimethyl-1-(2-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL374701
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2cc(n(c2C)c2ccccc2C)C)/C1=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 C28H28N2O3S MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O3S/c1-6-33-28(32)25-26(31)24(34-27(25)29-22-13-11-17(2)12-14-22)16-21-15-19(4)30(20(21)5)23-10-8-7-9-18(23)3/h7-16,29H,6H2,1-5H3/b24-16-InChIKey
RKYKDWUNGSMTCX-JLPGSUDCSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)C)SC(=Cc2cc(n(c2C)c2ccccc2C)C)C1=O
CCOC(=O)C1=C(SC(=CC2=C(N(C(=C2)C)C3=CC=CC=C3C)C)C1=O)NC4=CC=C(C=C4)C
ethyl(5Z)5((25dimethyl1(2methylphenyl)1Hpyrrol3yl)methylidene)2((4methylphenyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL(5Z)5((25DIMETHYL1(2METHYLPHENYL)PYRROL3YL)METHYLIDENE)2(4METHYLANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL5((25DIMETHYL1(2METHYLPHENYL)1HPYRROL3YL)METHYLENE)4OXO2(4TOLUIDINO)45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC28H28N2O3Sc163328(32)2526(31)24(3427(25)2922131117(2)121422)16211519(4)30(20(21)5)231087918(23)3h71629H6H215H3b2416
MFCD02787156
ZINC000008438398
ZINC08438398
ZINC8438398
Check stock
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