(E)-1-(4-methyl-3-nitro-phenyl)-3-[(4-methylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: (E)-1-(4-methyl-3-nitro-phenyl)-3-[(4-methylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(4-methylanilino)-1-(4-methyl-3-nitro-phenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(4-methylanilino)-1-(4-methyl-3-nitrophenyl)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(4-methylanilino)-1-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-1-(4-methyl-3-nitro-phenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-(p-toluidino)-3-thioxo-prop-1-en-1-olate Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)C(=C(C2=CC(=C(C=C2)C)[N+](=O)[O-])[O-])[N+]3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)/C(=C(/C2=CC(=C(C=C2)C)[N+](=O)[O-])\[O-])/[N+]3=CC=CC(=C3)C

InChI

InChI=1S/C23H21N3O3S/c1-15-6-10-19(11-7-15)24-23(30)21(25-12-4-5-16(2)14-25)22(27)18-9-8-17(3)20(13-18)26(28)29/h4-14H,1-3H3,(H-,24,27,30)