1-(5-chloranylthiophen-2-yl)-3-[(2,3-dimethylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-3-[(2,3-dimethylphenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-(5-chloro-2-thienyl)-3-(2,3-dimethylanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: 1-(5-chloro-2-thiophenyl)-3-(2,3-dimethylanilino)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-(5-chlorothiophen-2-yl)-3-(2,3-dimethylanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(5-chloro-2-thienyl)-3-(2,3-dimethylanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate Formula: C21H19ClN2OS2 MolecularWeight: 414.97136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1=C[N+](=CC=C1)C(=C(C2=CC=C(S2)Cl)[O-])C(=S)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C21H19ClN2OS2/c1-13-6-5-11-24(12-13)19(20(25)17-9-10-18(22)27-17)21(26)23-16-8-4-7-14(2)15(16)3/h4-12H,1-3H3,(H-,23,25,26)