3-[(3-chlorophenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione

Systemtic Name: 3-[(3-chlorophenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione Openeye Name: 3-(3-chloroanilino)-1-(4-isopropylphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(3-chloroanilino)-4-[(4-methylphenyl)thio]-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione IUPAC Name: 3-(3-chloroanilino)-4-(4-methylphenyl)sulfanyl-1-(4-propan-2-ylphenyl)pyrrole-2,5-dione Traditional Name: 3-(3-chloroanilino)-1-p-cumenyl-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C26H23ClN2O2S MolecularWeight: 462.99102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN2O2S/c1-16(2)18-9-11-21(12-10-18)29-25(30)23(28-20-6-4-5-19(27)15-20)24(26(29)31)32-22-13-7-17(3)8-14-22/h4-16,28H,1-3H3