[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-(4-methylsulfanylanilino)-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[4-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylanilino)-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-keto-2-[4-(methylthio)anilino]ethyl] ester Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C15H15N3O3S/c1-10-7-17-13(8-16-10)15(20)21-9-14(19)18-11-3-5-12(22-2)6-4-11/h3-8H,9H2,1-2H3,(H,18,19)