2-[2,3-bis(oxidanyl)propylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one

Systemtic Name: 2-[2,3-bis(oxidanyl)propylsulfanyl]-3-(2,4-dimethylphenyl)quinazolin-4-one Openeye Name: 2-(2,3-dihydroxypropylsulfanyl)-3-(2,4-dimethylphenyl)quinazolin-4-one CAS Name: 2-(2,3-dihydroxypropylthio)-3-(2,4-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-(2,3-dihydroxypropylsulfanyl)-3-(2,4-dimethylphenyl)quinazolin-4-one Traditional Name: 3-(2,4-dimethylphenyl)-2-(glycerylthio)quinazolin-4-one Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(CO)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(CO)O)C

InChI

InChI=1S/C19H20N2O3S/c1-12-7-8-17(13(2)9-12)21-18(24)15-5-3-4-6-16(15)20-19(21)25-11-14(23)10-22/h3-9,14,22-23H,10-11H2,1-2H3