3-[(4-methylphenyl)methyl]-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-(p-tolylmethyl)quinazolin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-[(4-methylphenyl)methyl]-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-3-(4-methylbenzyl)quinazolin-4-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCCC4

InChI

InChI=1S/C23H25N3O2S/c1-17-9-11-18(12-10-17)15-26-22(28)19-7-3-4-8-20(19)24-23(26)29-16-21(27)25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-16H2,1H3