Vitas-M small molecule compound
ethyl 2-{[(6-chloro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
Catalog ID
STK429015
SMILES CCOC(=O)c1c(NC(=O)c2cc3cc(Cl)ccc3oc2=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 C26H22ClNO5S MW 495.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClNO5S/c1-5-32-26(31)22-21(16-7-6-13(2)14(3)10-16)15(4)34-24(22)28-23(29)19-12-17-11-18(27)8-9-20(17)33-25(19)30/h6-12H,5H2,1-4H3,(H,28,29)InChIKey
SJSAXXKAZAYTKB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)C)C)C)NC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3=O
ETHYL2(((6CHLORO2OXO2HCHROMEN3YL)CARBONYL)AMINO)4(34DIMETHYLPHENYL)5METHYL3THIOPHENECARBOXYLATE
ethyl2(((6chloro2oxo2Hchromen3yl)carbonyl)amino)4(34dimethylphenyl)5methylthiophene3carboxylate
ETHYL2((6CHLORO2OXOCHROMENE3CARBONYL)AMINO)4(34DIMETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ETHYL4(34DIMETHYLPHENYL)2((6CHLORO2OXOCHROMEN3YL)CARBONYLAMINO)5METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC26H22ClNO5Sc153226(31)2221(167613(2)14(3)1016)15(4)3424(22)2823(29)1912171118(27)8920(17)3325(19)30h612H5H214H3(H2829)
MFCD03233265
ZINC000002789268
ZINC02789268
ZINC2789268
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