3-[(4-chlorophenyl)amino]-4-(4-methylpyridin-1-ium-1-yl)-1-(3-methylsulfanylphenyl)pyrrole-2,5-dione

Systemtic Name: 3-[(4-chlorophenyl)amino]-4-(4-methylpyridin-1-ium-1-yl)-1-(3-methylsulfanylphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-chloroanilino)-4-(4-methylpyridin-1-ium-1-yl)-1-(3-methylsulfanylphenyl)pyrrole-2,5-dione CAS Name: 3-(4-chloroanilino)-4-(4-methyl-1-pyridin-1-iumyl)-1-[3-(methylthio)phenyl]pyrrole-2,5-dione IUPAC Name: 3-(4-chloroanilino)-4-(4-methylpyridin-1-ium-1-yl)-1-(3-methylsulfanylphenyl)pyrrole-2,5-dione Traditional Name: 3-(4-chloroanilino)-4-(4-methylpyridin-1-ium-1-yl)-1-[3-(methylthio)phenyl]-3-pyrroline-2,5-quinone Formula: C23H19ClN3O2S+ MolecularWeight: 436.93386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C2=C(C(=O)N(C2=O)C3=CC(=CC=C3)SC)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=[N+](C=C1)C2=C(C(=O)N(C2=O)C3=CC(=CC=C3)SC)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O2S/c1-15-10-12-26(13-11-15)21-20(25-17-8-6-16(24)7-9-17)22(28)27(23(21)29)18-4-3-5-19(14-18)30-2/h3-14H,1-2H3/p+1