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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(4-ethoxyphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(4-ethoxyanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3-(4-ethoxyanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(4-ethoxyanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(phenylthio)-4-(p-phenetidino)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)SC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)SC4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O3S/c1-3-31-19-13-10-17(11-14-19)27-22-23(32-20-7-5-4-6-8-20)25(30)28(24(22)29)18-12-9-16(2)21(26)15-18/h4-15,27H,3H2,1-2H3