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

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[(3-methylphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(3-methylanilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-(3-methylanilino)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(3-methylanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(m-toluidino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)NC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)NC4=CC=CC(=C4)C

InChI

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