1-(2-methylpropyl)-4-[(2S)-1-phenyl-3-phenylsulfanyl-propan-2-yl]-1,4-diazepan-5-one

Systemtic Name: 1-(2-methylpropyl)-4-[(2S)-1-phenyl-3-phenylsulfanyl-propan-2-yl]-1,4-diazepan-5-one Openeye Name: 4-[(1S)-1-benzyl-2-phenylsulfanyl-ethyl]-1-isobutyl-1,4-diazepan-5-one CAS Name: 1-(2-methylpropyl)-4-[(2S)-1-phenyl-3-(phenylthio)propan-2-yl]-1,4-diazepan-5-one IUPAC Name: 1-(2-methylpropyl)-4-[(2S)-1-phenyl-3-phenylsulfanylpropan-2-yl]-1,4-diazepan-5-one Traditional Name: 4-[(1S)-1-benzyl-2-(phenylthio)ethyl]-1-isobutyl-1,4-diazepan-5-one Formula: C24H32N2OS MolecularWeight: 396.58868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCC(=O)N(CC1)C(CC2=CC=CC=C2)CSC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1CCC(=O)N(CC1)[C@@H](CC2=CC=CC=C2)CSC3=CC=CC=C3

InChI

InChI=1S/C24H32N2OS/c1-20(2)18-25-14-13-24(27)26(16-15-25)22(17-21-9-5-3-6-10-21)19-28-23-11-7-4-8-12-23/h3-12,20,22H,13-19H2,1-2H3/t22-/m0/s1