1-(4-chloranyl-2-methyl-phenyl)-3-[(4-ethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-[(4-ethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-(4-ethylanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(4-chloro-2-methylphenyl)-3-(4-ethylanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-(4-ethylanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-(4-ethylanilino)-4-(phenylthio)-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)C3=C(C=C(C=C3)Cl)C)SC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H21ClN2O2S/c1-3-17-9-12-19(13-10-17)27-22-23(31-20-7-5-4-6-8-20)25(30)28(24(22)29)21-14-11-18(26)15-16(21)2/h4-15,27H,3H2,1-2H3