3-(2,3-dimethylphenyl)-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(2,3-dimethylphenyl)-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(2,3-dimethylphenyl)-2-(tetrahydropyran-2-ylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(2,3-dimethylphenyl)-2-(2-oxanylmethylthio)-4-quinazolinone IUPAC Name: 3-(2,3-dimethylphenyl)-2-(oxan-2-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(2,3-dimethylphenyl)-2-(tetrahydropyran-2-ylmethylthio)quinazolin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4CCCCO4)C

InChI

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