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

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-[ethyl(phenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-(N-ethylanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 1-(4-chloro-2-methylphenyl)-3-(N-ethylanilino)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-(N-ethylanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-(N-ethylanilino)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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