2-[(4-chlorophenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-6,7-dimethoxy-quinazolin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-6,7-dimethoxy-quinazolin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-6,7-dimethoxy-quinazolin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-3-[2-(1-cyclohexenyl)ethyl]-6,7-dimethoxy-4-quinazolinone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-[2-(cyclohexen-1-yl)ethyl]-6,7-dimethoxyquinazolin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-3-[2-(cyclohexen-1-yl)ethyl]-6,7-dimethoxy-quinazolin-4-one Formula: C25H27ClN2O3S MolecularWeight: 471.01148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)Cl)CCC4=CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)Cl)CCC4=CCCCC4)OC

InChI

InChI=1S/C25H27ClN2O3S/c1-30-22-14-20-21(15-23(22)31-2)27-25(32-16-18-8-10-19(26)11-9-18)28(24(20)29)13-12-17-6-4-3-5-7-17/h6,8-11,14-15H,3-5,7,12-13,16H2,1-2H3