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

Systemtic Name: (E)-3-[(3-methoxyphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(3-methoxyanilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-thioxo-prop-1-en-1-olate CAS Name: (E)-3-(3-methoxyanilino)-2-(3-methyl-1-pyridin-1-iumyl)-1-(4-nitrophenyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-3-(3-methoxyanilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-3-(m-anisidino)-2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)-3-thioxo-prop-1-en-1-olate Formula: C22H19N3O4S MolecularWeight: 421.46896

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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=C3)OC

Isomeric SMILES

CC1=C[N+](=CC=C1)/C(=C(\C2=CC=C(C=C2)[N+](=O)[O-])/[O-])/C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H19N3O4S/c1-15-5-4-12-24(14-15)20(21(26)16-8-10-18(11-9-16)25(27)28)22(30)23-17-6-3-7-19(13-17)29-2/h3-14H,1-2H3,(H-,23,26,30)