3-[2-(cyclohexen-1-yl)ethyl]-2-(5-methyl-2-oxidanylidene-oxolan-3-yl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(5-methyl-2-oxidanylidene-oxolan-3-yl)sulfanyl-quinazolin-4-one Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(5-methyl-2-oxo-tetrahydrofuran-3-yl)sulfanyl-quinazolin-4-one CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2-[(5-methyl-2-oxo-3-oxolanyl)thio]-4-quinazolinone IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(5-methyl-2-oxooxolan-3-yl)sulfanylquinazolin-4-one Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(2-keto-5-methyl-tetrahydrofuran-3-yl)thio]quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)SC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

Isomeric SMILES

CC1CC(C(=O)O1)SC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

InChI

InChI=1S/C21H24N2O3S/c1-14-13-18(20(25)26-14)27-21-22-17-10-6-5-9-16(17)19(24)23(21)12-11-15-7-3-2-4-8-15/h5-7,9-10,14,18H,2-4,8,11-13H2,1H3