ethyl 4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-oxo-2-(p-tolylmethylsulfanyl)quinazolin-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-[(4-methylphenyl)methylthio]-4-oxo-3-quinazolinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-keto-2-[(4-methylbenzyl)thio]quinazolin-3-yl]piperidine-1-carboxylic acid ethyl ester Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C

InChI

InChI=1S/C24H27N3O3S/c1-3-30-24(29)26-14-12-19(13-15-26)27-22(28)20-6-4-5-7-21(20)25-23(27)31-16-18-10-8-17(2)9-11-18/h4-11,19H,3,12-16H2,1-2H3