3-[[1-(5-chloranyl-2-methoxy-phenyl)-2,5-bis(oxidanylidene)-4-phenylsulfanyl-pyrrol-3-yl]amino]benzoate

Systemtic Name: 3-[[1-(5-chloranyl-2-methoxy-phenyl)-2,5-bis(oxidanylidene)-4-phenylsulfanyl-pyrrol-3-yl]amino]benzoate Openeye Name: 3-[[1-(5-chloro-2-methoxy-phenyl)-2,5-dioxo-4-phenylsulfanyl-pyrrol-3-yl]amino]benzoate CAS Name: 3-[[1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-4-(phenylthio)-3-pyrrolyl]amino]benzoate IUPAC Name: 3-[[1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-4-phenylsulfanylpyrrol-3-yl]amino]benzoate Traditional Name: 3-[[1-(5-chloro-2-methoxy-phenyl)-2,5-diketo-4-(phenylthio)-3-pyrrolin-3-yl]amino]benzoate Formula: C24H16ClN2O5S- MolecularWeight: 479.91224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C24H17ClN2O5S/c1-32-19-11-10-15(25)13-18(19)27-22(28)20(26-16-7-5-6-14(12-16)24(30)31)21(23(27)29)33-17-8-3-2-4-9-17/h2-13,26H,1H3,(H,30,31)/p-1