3-[(4-chlorophenyl)amino]-4-[6-(4-methylphenyl)sulfanylpyridin-2-yl]-1-phenyl-pyrrole-2,5-dione

Systemtic Name: 3-[(4-chlorophenyl)amino]-4-[6-(4-methylphenyl)sulfanylpyridin-2-yl]-1-phenyl-pyrrole-2,5-dione Openeye Name: 3-(4-chloroanilino)-1-phenyl-4-[6-(p-tolylsulfanyl)-2-pyridyl]pyrrole-2,5-dione CAS Name: 3-(4-chloroanilino)-4-[6-[(4-methylphenyl)thio]-2-pyridinyl]-1-phenylpyrrole-2,5-dione IUPAC Name: 3-(4-chloroanilino)-4-[6-(4-methylphenyl)sulfanylpyridin-2-yl]-1-phenylpyrrole-2,5-dione Traditional Name: 3-(4-chloroanilino)-1-phenyl-4-[6-(p-tolylthio)-2-pyridyl]-3-pyrroline-2,5-quinone Formula: C28H20ClN3O2S MolecularWeight: 497.9953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=CC(=N2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)NC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=CC(=N2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)NC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H20ClN3O2S/c1-18-10-16-22(17-11-18)35-24-9-5-8-23(31-24)25-26(30-20-14-12-19(29)13-15-20)28(34)32(27(25)33)21-6-3-2-4-7-21/h2-17,30H,1H3