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

Systemtic Name: (Z)-1-(2-bromophenyl)-3-(ethylamino)-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: (Z)-1-(2-bromophenyl)-3-(ethylamino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: (Z)-1-(2-bromophenyl)-3-(ethylamino)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: (Z)-1-(2-bromophenyl)-3-(ethylamino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: (Z)-1-(2-bromophenyl)-3-(ethylamino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C16H15BrN2OS MolecularWeight: 363.2721

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)C(=C(C1=CC=CC=C1Br)[O-])[N+]2=CC=CC=C2

Isomeric SMILES

CCNC(=S)/C(=C(\C1=CC=CC=C1Br)/[O-])/[N+]2=CC=CC=C2

InChI

InChI=1S/C16H15BrN2OS/c1-2-18-16(21)14(19-10-6-3-7-11-19)15(20)12-8-4-5-9-13(12)17/h3-11H,2H2,1H3,(H-,18,20,21)