1-(5-chloranyl-2-methoxy-phenyl)-3-[(2,4-dimethoxyphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[(2,4-dimethoxyphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(2,4-dimethoxyanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(2,4-dimethoxyanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(2,4-dimethoxyanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(2,4-dimethoxyanilino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O5S MolecularWeight: 496.96264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)SC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)SC4=CC=CC=C4)OC

InChI

InChI=1S/C25H21ClN2O5S/c1-31-16-10-11-18(21(14-16)33-3)27-22-23(34-17-7-5-4-6-8-17)25(30)28(24(22)29)19-13-15(26)9-12-20(19)32-2/h4-14,27H,1-3H3