[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)COC(=O)C2=NC=CN=C2

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)COC(=O)C2=NC=CN=C2

InChI

InChI=1S/C14H13N3O3S/c1-21-11-4-2-3-10(7-11)17-13(18)9-20-14(19)12-8-15-5-6-16-12/h2-8H,9H2,1H3,(H,17,18)