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

Systemtic Name: 4-[1-(4-methoxyphenyl)sulfanyl-3-phenyl-propan-2-yl]-1-(2-methylpropyl)-1,4-diazepan-5-one Openeye Name: 4-[1-benzyl-2-(4-methoxyphenyl)sulfanyl-ethyl]-1-isobutyl-1,4-diazepan-5-one CAS Name: 4-[1-[(4-methoxyphenyl)thio]-3-phenylpropan-2-yl]-1-(2-methylpropyl)-1,4-diazepan-5-one IUPAC Name: 4-[1-(4-methoxyphenyl)sulfanyl-3-phenylpropan-2-yl]-1-(2-methylpropyl)-1,4-diazepan-5-one Traditional Name: 4-[1-benzyl-2-[(4-methoxyphenyl)thio]ethyl]-1-isobutyl-1,4-diazepan-5-one Formula: C25H34N2O2S MolecularWeight: 426.61466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O2S/c1-20(2)18-26-14-13-25(28)27(16-15-26)22(17-21-7-5-4-6-8-21)19-30-24-11-9-23(29-3)10-12-24/h4-12,20,22H,13-19H2,1-3H3