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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-[(4-ethylphenyl)amino]-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(4-ethylanilino)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(4-ethylanilino)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(4-ethylanilino)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4-chlorophenyl)thio]-4-(4-ethylanilino)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O2S/c1-2-17-8-12-20(13-9-17)27-22-23(31-21-14-10-19(26)11-15-21)25(30)28(24(22)29)16-18-6-4-3-5-7-18/h3-15,27H,2,16H2,1H3