3-[(2,4-dimethylphenyl)amino]-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 3-[(2,4-dimethylphenyl)amino]-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(2,4-dimethylanilino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 3-(2,4-dimethylanilino)-1-(4-ethylphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(2,4-dimethylanilino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-(2,4-dimethylanilino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C24H24N2OS MolecularWeight: 388.52516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=C(C(=S)NC2=C(C=C(C=C2)C)C)[N+]3=CC=CC=C3)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=C(C(=S)NC2=C(C=C(C=C2)C)C)[N+]3=CC=CC=C3)[O-]

InChI

InChI=1S/C24H24N2OS/c1-4-19-9-11-20(12-10-19)23(27)22(26-14-6-5-7-15-26)24(28)25-21-13-8-17(2)16-18(21)3/h5-16H,4H2,1-3H3,(H-,25,27,28)