3-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxo-4-phenyl-butyl)sulfanyl-quinazolin-4-one CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2-[(4-oxo-4-phenylbutyl)thio]-4-quinazolinone IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxo-4-phenylbutyl)sulfanylquinazolin-4-one Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(4-keto-4-phenyl-butyl)thio]quinazolin-4-one Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=CC1)CCN2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O2S/c29-24(21-12-5-2-6-13-21)16-9-19-31-26-27-23-15-8-7-14-22(23)25(30)28(26)18-17-20-10-3-1-4-11-20/h2,5-8,10,12-15H,1,3-4,9,11,16-19H2