3-[(3-chlorophenyl)amino]-1-(4-phenoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 3-[(3-chlorophenyl)amino]-1-(4-phenoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(3-chloroanilino)-1-(4-phenoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(3-chloroanilino)-1-(4-phenoxyphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(3-chloroanilino)-1-(4-phenoxyphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(3-chloroanilino)-1-(4-phenoxyphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C28H19ClN2O3S MolecularWeight: 498.98006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C(=C(C3=O)SC4=CC=CC=C4)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C(=C(C3=O)SC4=CC=CC=C4)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H19ClN2O3S/c29-19-8-7-9-20(18-19)30-25-26(35-24-12-5-2-6-13-24)28(33)31(27(25)32)21-14-16-23(17-15-21)34-22-10-3-1-4-11-22/h1-18,30H