[1-[2-(4,5-dihydro-1,3-thiazol-2-yl)ethyl]-4-oxidanylidene-pyridin-3-yl] benzoate

Systemtic Name: [1-[2-(4,5-dihydro-1,3-thiazol-2-yl)ethyl]-4-oxidanylidene-pyridin-3-yl] benzoate Openeye Name: [1-[2-(4,5-dihydrothiazol-2-yl)ethyl]-4-oxo-3-pyridyl] benzoate CAS Name: benzoic acid [1-[2-(4,5-dihydrothiazol-2-yl)ethyl]-4-oxo-3-pyridinyl] ester IUPAC Name: [1-[2-(4,5-dihydro-1,3-thiazol-2-yl)ethyl]-4-oxopyridin-3-yl] benzoate Traditional Name: benzoic acid [4-keto-1-[2-(2-thiazolin-2-yl)ethyl]-3-pyridyl] ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)CCN2C=CC(=O)C(=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CSC(=N1)CCN2C=CC(=O)C(=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2O3S/c20-14-6-9-19(10-7-16-18-8-11-23-16)12-15(14)22-17(21)13-4-2-1-3-5-13/h1-6,9,12H,7-8,10-11H2