methyl 1-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[(4-oxo-1H-quinazolin-2-yl)thio]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-keto-1H-quinazolin-2-yl)thio]acetyl]isonipecotic acid methyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H19N3O4S/c1-24-16(23)11-6-8-20(9-7-11)14(21)10-25-17-18-13-5-3-2-4-12(13)15(22)19-17/h2-5,11H,6-10H2,1H3,(H,18,19,22)