Vitas-M small molecule compound
methyl (5Z)-2-[(3,4-dichlorophenyl)amino]-4-oxo-5-(pyridin-3-ylmethylidene)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158503
SMILES COC(=O)C1=C(Nc2ccc(c(c2)Cl)Cl)S/C(=C\c2cccnc2)/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 C18H12Cl2N2O3S MW 407.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2N2O3S/c1-25-18(24)15-16(23)14(7-10-3-2-6-21-9-10)26-17(15)22-11-4-5-12(19)13(20)8-11/h2-9,22H,1H3/b14-7-InChIKey
IILPOQLTNJPSIP-AUWJEWJLSA-NSynonyms
COC(=O)C1=C(Nc2ccc(c(c2)Cl)Cl)SC(=Cc2cccnc2)C1=O
COC(=O)C1=C(SC(=CC2=CN=CC=C2)C1=O)NC3=CC(=C(C=C3)Cl)Cl
InChI=1SC18H12Cl2N2O3Sc12518(24)1516(23)14(71032621910)2617(15)22114512(19)13(20)811h2922H1H3b147
METHYL(5Z)2((34DICHLOROPHENYL)AMINO)4OXO5(PYRIDIN3YLMETHYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
METHYL(5Z)2(34DICHLOROANILINO)4OXO5(PYRIDIN3YLMETHYLIDENE)THIOPHENE3CARBOXYLATE
MFCD06243257
ZINC000004688365
ZINC04688365
ZINC4688365
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