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

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-3-[(3-methylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(3-methylanilino)-1-(4-methyl-3-nitro-phenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-(3-methylanilino)-1-(4-methyl-3-nitrophenyl)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(3-methylanilino)-1-(4-methyl-3-nitrophenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-(m-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(=CC=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(=CC=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/c1-15-6-4-8-19(12-15)24-23(30)21(25-11-5-7-16(2)14-25)22(27)18-10-9-17(3)20(13-18)26(28)29/h4-14H,1-3H3,(H-,24,27,30)