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

Systemtic Name: (E)-1-(3,4-dimethylphenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-(prop-2-enylamino)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(allylamino)-1-(3,4-dimethylphenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate CAS Name: (E)-1-(3,4-dimethylphenyl)-2-(3-methyl-1-pyridin-1-iumyl)-3-(prop-2-enylamino)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (E)-1-(3,4-dimethylphenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-(prop-2-enylamino)-3-sulfanylideneprop-1-en-1-olate Traditional Name: (E)-3-(allylamino)-1-(3,4-dimethylphenyl)-2-(3-methylpyridin-1-ium-1-yl)-3-thioxo-prop-1-en-1-olate Formula: C20H22N2OS MolecularWeight: 338.46648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2OS/c1-5-10-21-20(24)18(22-11-6-7-14(2)13-22)19(23)17-9-8-15(3)16(4)12-17/h5-9,11-13H,1,10H2,2-4H3,(H-,21,23,24)