2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: 2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylate Openeye Name: 2-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]thio]-3-pyridinecarboxylate IUPAC Name: 2-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]thio]nicotinate Formula: C15H12FN2O3S- MolecularWeight: 319.330783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NCC2=CC=C(C=C2)F)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NCC2=CC=C(C=C2)F)C(=O)[O-]

InChI

InChI=1S/C15H13FN2O3S/c16-11-5-3-10(4-6-11)8-18-13(19)9-22-14-12(15(20)21)2-1-7-17-14/h1-7H,8-9H2,(H,18,19)(H,20,21)/p-1