(Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (Z)-3-(ethylamino)-1-(4-ethylphenyl)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C18H20N2OS MolecularWeight: 312.4292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=C(C(=S)NCC)[N+]2=CC=CC=C2)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)/C(=C(\C(=S)NCC)/[N+]2=CC=CC=C2)/[O-]

InChI

InChI=1S/C18H20N2OS/c1-3-14-8-10-15(11-9-14)17(21)16(18(22)19-4-2)20-12-6-5-7-13-20/h5-13H,3-4H2,1-2H3,(H-,19,21,22)