methyl 1-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetyl]isonipecotic acid methyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O4S/c1-30-22(29)16-11-13-25(14-12-16)20(27)15-31-23-24-19-10-6-5-9-18(19)21(28)26(23)17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3