1-(2-bromophenyl)-3-[(4-chlorophenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-(2-bromophenyl)-3-[(4-chlorophenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-(2-bromophenyl)-3-(4-chloroanilino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate CAS Name: 1-(2-bromophenyl)-3-(4-chloroanilino)-2-(1-pyridin-1-iumyl)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-(2-bromophenyl)-3-(4-chloroanilino)-2-pyridin-1-ium-1-yl-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-(2-bromophenyl)-3-(4-chloroanilino)-2-pyridin-1-ium-1-yl-3-thioxo-prop-1-en-1-olate Formula: C20H14BrClN2OS MolecularWeight: 445.75996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=C(C2=CC=CC=C2Br)[O-])C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=[N+](C=C1)C(=C(C2=CC=CC=C2Br)[O-])C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H14BrClN2OS/c21-17-7-3-2-6-16(17)19(25)18(24-12-4-1-5-13-24)20(26)23-15-10-8-14(22)9-11-15/h1-13H,(H-,23,25,26)