3-[2-(cyclohexen-1-yl)ethyl]-2-[(3-methoxyphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(3-methoxyphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(3-methoxyphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-2-[(3-methoxyphenyl)methylthio]-4-quinazolinone IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-[(3-methoxyphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[2-(cyclohexen-1-yl)ethyl]-2-(m-anisylthio)quinazolin-4-one Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

InChI

InChI=1S/C24H26N2O2S/c1-28-20-11-7-10-19(16-20)17-29-24-25-22-13-6-5-12-21(22)23(27)26(24)15-14-18-8-3-2-4-9-18/h5-8,10-13,16H,2-4,9,14-15,17H2,1H3