3-(4-chlorophenyl)sulfanyl-4-[(2-ethoxyphenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-[(2-ethoxyphenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(2-ethoxyanilino)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(2-ethoxyanilino)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(2-ethoxyanilino)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4-chlorophenyl)thio]-4-(o-phenetidino)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O3S/c1-2-31-21-11-7-6-10-20(21)27-22-23(32-19-14-12-18(26)13-15-19)25(30)28(24(22)29)16-17-8-4-3-5-9-17/h3-15,27H,2,16H2,1H3