4-[(2-fluorophenyl)methyl]-1-(2-methylsulfanylphenyl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(2-fluorophenyl)methyl]-1-(2-methylsulfanylphenyl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(2-fluorophenyl)methyl]-1-(2-methylsulfanylbenzoyl)-1,4-diazepan-5-one CAS Name: 4-[(2-fluorophenyl)methyl]-1-[[2-(methylthio)phenyl]-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-fluorophenyl)methyl]-1-(2-methylsulfanylbenzoyl)-1,4-diazepan-5-one Traditional Name: 4-(2-fluorobenzyl)-1-[2-(methylthio)benzoyl]-1,4-diazepan-5-one Formula: C20H21FN2O2S MolecularWeight: 372.456343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3F

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C20H21FN2O2S/c1-26-18-9-5-3-7-16(18)20(25)22-11-10-19(24)23(13-12-22)14-15-6-2-4-8-17(15)21/h2-9H,10-14H2,1H3