1-(2-methylpropyl)-4-[(6-methylpyridin-2-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-4-[(6-methylpyridin-2-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-isobutyl-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[(6-methyl-2-pyridinyl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-[(6-methylpyridin-2-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-isobutyl-4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-2-one Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC=C1)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-18(2)12-26-15-22(28-17-20-9-5-4-6-10-20)14-25(16-23(26)27)13-21-11-7-8-19(3)24-21/h4-11,18,22H,12-17H2,1-3H3