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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(3,4-dimethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(3,4-dimethylanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(3-chloro-4-methylphenyl)-3-(3,4-dimethylanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(3,4-dimethylanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(3,4-dimethylanilino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)SC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=C(C=C3)C)Cl)SC4=CC=CC=C4)C

InChI

InChI=1S/C25H21ClN2O2S/c1-15-9-11-18(13-17(15)3)27-22-23(31-20-7-5-4-6-8-20)25(30)28(24(22)29)19-12-10-16(2)21(26)14-19/h4-14,27H,1-3H3