3-[(4S)-2,2-dimethyloxan-4-yl]-2-phenethylsulfanyl-quinazolin-4-one

Systemtic Name: 3-[(4S)-2,2-dimethyloxan-4-yl]-2-phenethylsulfanyl-quinazolin-4-one Openeye Name: 3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-2-phenethylsulfanyl-quinazolin-4-one CAS Name: 3-[(4S)-2,2-dimethyl-4-oxanyl]-2-(phenethylthio)-4-quinazolinone IUPAC Name: 3-[(4S)-2,2-dimethyloxan-4-yl]-2-phenethylsulfanylquinazolin-4-one Traditional Name: 3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-2-(phenethylthio)quinazolin-4-one Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C[C@H](CCO1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=CC=C4)C

InChI

InChI=1S/C23H26N2O2S/c1-23(2)16-18(12-14-27-23)25-21(26)19-10-6-7-11-20(19)24-22(25)28-15-13-17-8-4-3-5-9-17/h3-11,18H,12-16H2,1-2H3/t18-/m0/s1