3-[(3-methoxyphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-[(3-methoxyphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(3-methoxyanilino)-1-phenethyl-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(3-methoxyanilino)-4-[(4-methylphenyl)thio]-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(3-methoxyanilino)-4-(4-methylphenyl)sulfanyl-1-phenethylpyrrole-2,5-dione Traditional Name: 3-(m-anisidino)-1-phenethyl-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C26H24N2O3S MolecularWeight: 444.54536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H24N2O3S/c1-18-11-13-22(14-12-18)32-24-23(27-20-9-6-10-21(17-20)31-2)25(29)28(26(24)30)16-15-19-7-4-3-5-8-19/h3-14,17,27H,15-16H2,1-2H3