Vitas-M small molecule compound
methyl 4-{(E)-[(2Z)-2-{2-[(2-chlorophenyl)amino]-1-cyano-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]methyl}benzoate
Catalog ID
STK740715
SMILES COC(=O)c1ccc(cc1)/C=c\1/s/c(=C(\C(=O)Nc2ccccc2Cl)/C#N)/n(c1=O)c1ccccc1
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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 C27H18ClN3O4S MW 515.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClN3O4S/c1-35-27(34)18-13-11-17(12-14-18)15-23-25(33)31(19-7-3-2-4-8-19)26(36-23)20(16-29)24(32)30-22-10-6-5-9-21(22)28/h2-15H,1H3,(H,30,32)/b23-15+,26-20-InChIKey
VAQZAAYKRGEGNS-MPFILJMLSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=C(C#N)C(=O)NC3=CC=CC=C3Cl)S2)C4=CC=CC=C4
COC(=O)c1ccc(cc1)C=c1sc(=C(C(=O)Nc2ccccc2Cl)C#N)n(c1=O)c1ccccc1
InChI=1SC27H18ClN3O4Sc13527(34)18131117(121418)152325(33)31(197324819)26(3623)20(1629)24(32)30221065921(22)28h215H1H3(H3032)b2315+2620
METHYL4((2((N(2CHLOROPHENYL)CARBAMOYL)CYANOMETHYLENE)4OXO3PHENYL13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
methyl4((E)((2Z)2(2((2chlorophenyl)amino)1cyano2oxoethylidene)4oxo3phenyl13thiazolidin5ylidene)methyl)benzoate
methyl4((E)((2Z)2(2(2chloroanilino)1cyano2oxoethylidene)4oxo3phenyl13thiazolidin5ylidene)methyl)benzoate
methyl4((E)((E)2(2((2chlorophenyl)amino)1cyano2oxoethylidene)4oxo3phenylthiazolidin5ylidene)methyl)benzoate
MFCD06438537
ZINC000008951687
ZINC08951687
ZINC8951687
Check stock
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Check stock on Vitas-MAvailable files
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