(Z)-1-(3,4-dimethylphenyl)-3-(prop-2-enylamino)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-1-(3,4-dimethylphenyl)-3-(prop-2-enylamino)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (Z)-3-(allylamino)-1-(3,4-dimethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (Z)-1-(3,4-dimethylphenyl)-3-(prop-2-enylamino)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (Z)-1-(3,4-dimethylphenyl)-3-(prop-2-enylamino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (Z)-3-(allylamino)-1-(3,4-dimethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=C(C(=S)NCC=C)[N+]2=CC=CC=C2)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=C(\C(=S)NCC=C)/[N+]2=CC=CC=C2)/[O-])C

InChI

InChI=1S/C19H20N2OS/c1-4-10-20-19(23)17(21-11-6-5-7-12-21)18(22)16-9-8-14(2)15(3)13-16/h4-9,11-13H,1,10H2,2-3H3,(H-,20,22,23)