[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] 2-oxo-1H-pyridine-3-carboxylate CAS Name: 2-oxo-1H-pyridine-3-carboxylic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] 2-oxo-1H-pyridine-3-carboxylate Traditional Name: 2-keto-1H-pyridine-3-carboxylic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C16H15BrN2O4S MolecularWeight: 411.2703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=O)C(=C1)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CNC(=O)C(=C1)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrN2O4S/c17-11-3-5-12(6-4-11)24-9-8-18-14(20)10-23-16(22)13-2-1-7-19-15(13)21/h1-7H,8-10H2,(H,18,20)(H,19,21)