3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylthio]-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-cyclohexyl-2-[(2-fluorobenzyl)thio]benzothiopheno[3,2-d]pyrimidin-4-one Formula: C23H21FN2OS2 MolecularWeight: 424.554043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SCC5=CC=CC=C5F

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SCC5=CC=CC=C5F

InChI

InChI=1S/C23H21FN2OS2/c24-18-12-6-4-8-15(18)14-28-23-25-20-17-11-5-7-13-19(17)29-21(20)22(27)26(23)16-9-2-1-3-10-16/h4-8,11-13,16H,1-3,9-10,14H2