6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(3-methylsulfanylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(3-methylsulfanylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-[(2-fluorophenyl)methoxy]-1-isobutyl-4-(3-methylsulfanylpropanoyl)-1,4-diazepan-2-one CAS Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-[3-(methylthio)-1-oxopropyl]-1,4-diazepan-2-one IUPAC Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(3-methylsulfanylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-(2-fluorobenzyl)oxy-1-isobutyl-4-[3-(methylthio)propanoyl]-1,4-diazepan-2-one Formula: C20H29FN2O3S MolecularWeight: 396.519263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)CCSC)OCC2=CC=CC=C2F

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)CCSC)OCC2=CC=CC=C2F

InChI

InChI=1S/C20H29FN2O3S/c1-15(2)10-22-11-17(26-14-16-6-4-5-7-18(16)21)12-23(13-20(22)25)19(24)8-9-27-3/h4-7,15,17H,8-14H2,1-3H3