methyl 4-methylsulfanyl-2-[[2-phenyl-4-(1,3-thiazolidin-4-ylcarbonylamino)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[[2-phenyl-4-(1,3-thiazolidin-4-ylcarbonylamino)phenyl]carbonylamino]butanoate Openeye Name: methyl 4-methylsulfanyl-2-[[2-phenyl-4-(thiazolidine-4-carbonylamino)benzoyl]amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-[4-[[oxo(4-thiazolidinyl)methyl]amino]-2-phenylphenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-[[2-phenyl-4-(1,3-thiazolidine-4-carbonylamino)benzoyl]amino]butanoate Traditional Name: 4-(methylthio)-2-[[2-phenyl-4-(thiazolidine-4-carbonylamino)benzoyl]amino]butyric acid methyl ester Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)NC(=O)C2CSCN2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)NC(=O)C2CSCN2)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4S2/c1-30-23(29)19(10-11-31-2)26-21(27)17-9-8-16(25-22(28)20-13-32-14-24-20)12-18(17)15-6-4-3-5-7-15/h3-9,12,19-20,24H,10-11,13-14H2,1-2H3,(H,25,28)(H,26,27)