[3-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] pyrazine-2-carboxylate

Systemtic Name: [3-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] pyrazine-2-carboxylate Openeye Name: [3-(5-methyl-4-phenyl-thiazol-2-yl)-2-oxo-propyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [3-(5-methyl-4-phenyl-2-thiazolyl)-2-oxopropyl] ester IUPAC Name: [3-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-oxopropyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-keto-3-(5-methyl-4-phenyl-thiazol-2-yl)propyl] ester Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)CC(=O)COC(=O)C2=NC=CN=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(S1)CC(=O)COC(=O)C2=NC=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O3S/c1-12-17(13-5-3-2-4-6-13)21-16(25-12)9-14(22)11-24-18(23)15-10-19-7-8-20-15/h2-8,10H,9,11H2,1H3