3-(2,2-dimethyloxan-4-yl)-2-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-2-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-benzylsulfanyl-3-(2,2-dimethyltetrahydropyran-4-yl)quinazolin-4-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-2-(phenylmethylthio)-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one Traditional Name: 2-(benzylthio)-3-(2,2-dimethyltetrahydropyran-4-yl)quinazolin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C

InChI

InChI=1S/C22H24N2O2S/c1-22(2)14-17(12-13-26-22)24-20(25)18-10-6-7-11-19(18)23-21(24)27-15-16-8-4-3-5-9-16/h3-11,17H,12-15H2,1-2H3