3-cyclopentyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopentyl-2-[(3-fluoro-4-methoxyphenyl)methylthio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopentyl-2-[(3-fluoro-4-methoxy-benzyl)thio]quinazolin-4-one Formula: C21H21FN2O2S MolecularWeight: 384.467043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)F

InChI

InChI=1S/C21H21FN2O2S/c1-26-19-11-10-14(12-17(19)22)13-27-21-23-18-9-5-4-8-16(18)20(25)24(21)15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7,13H2,1H3