3-[(3-chloranyl-2-methyl-phenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-1-thiophen-2-yl-prop-1-en-1-olate

Systemtic Name: 3-[(3-chloranyl-2-methyl-phenyl)amino]-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-1-thiophen-2-yl-prop-1-en-1-olate Openeye Name: 3-(3-chloro-2-methyl-anilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(2-thienyl)-3-thioxo-prop-1-en-1-olate CAS Name: 3-(3-chloro-2-methylanilino)-2-(3-methyl-1-pyridin-1-iumyl)-3-sulfanylidene-1-thiophen-2-yl-1-propen-1-olate IUPAC Name: 3-(3-chloro-2-methylanilino)-2-(3-methylpyridin-1-ium-1-yl)-3-sulfanylidene-1-thiophen-2-ylprop-1-en-1-olate Traditional Name: 3-(3-chloro-2-methyl-anilino)-2-(3-methylpyridin-1-ium-1-yl)-1-(2-thienyl)-3-thioxo-prop-1-en-1-olate Formula: C20H17ClN2OS2 MolecularWeight: 400.94478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(=C(C2=CC=CS2)[O-])C(=S)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=C[N+](=CC=C1)C(=C(C2=CC=CS2)[O-])C(=S)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C20H17ClN2OS2/c1-13-6-4-10-23(12-13)18(19(24)17-9-5-11-26-17)20(25)22-16-8-3-7-15(21)14(16)2/h3-12H,1-2H3,(H-,22,24,25)