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

Systemtic Name: 3-[(2-methylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(2-methylanilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-(2-methylanilino)-2-(3-methyl-1-pyridin-1-iumyl)-1-(4-nitrophenyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(2-methylanilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-(o-toluidino)-3-thioxo-prop-1-en-1-olate Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-])C(=S)NC3=CC=CC=C3C

Isomeric SMILES

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-])C(=S)NC3=CC=CC=C3C

InChI

InChI=1S/C22H19N3O3S/c1-15-6-5-13-24(14-15)20(22(29)23-19-8-4-3-7-16(19)2)21(26)17-9-11-18(12-10-17)25(27)28/h3-14H,1-2H3,(H-,23,26,29)