2-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: 2-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[2-(2-bromoanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-(2-bromoanilino)-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[2-(2-bromoanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-(2-bromoanilino)-2-keto-ethyl]thio]nicotinate Formula: C14H10BrN2O3S- MolecularWeight: 366.2098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)[O-])Br

InChI

InChI=1S/C14H11BrN2O3S/c15-10-5-1-2-6-11(10)17-12(18)8-21-13-9(14(19)20)4-3-7-16-13/h1-7H,8H2,(H,17,18)(H,19,20)/p-1