3-(2,2-dimethyloxan-4-yl)-2-prop-2-enylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,2-dimethyloxan-4-yl)-2-prop-2-enylsulfanyl-quinazolin-4-one Openeye Name: 2-allylsulfanyl-3-(2,2-dimethyltetrahydropyran-4-yl)quinazolin-4-one CAS Name: 3-(2,2-dimethyl-4-oxanyl)-2-(prop-2-enylthio)-4-quinazolinone IUPAC Name: 3-(2,2-dimethyloxan-4-yl)-2-prop-2-enylsulfanylquinazolin-4-one Traditional Name: 2-(allylthio)-3-(2,2-dimethyltetrahydropyran-4-yl)quinazolin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC=C)C

Isomeric SMILES

CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC=C)C

InChI

InChI=1S/C18H22N2O2S/c1-4-11-23-17-19-15-8-6-5-7-14(15)16(21)20(17)13-9-10-22-18(2,3)12-13/h4-8,13H,1,9-12H2,2-3H3