4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-[(4-methoxyphenyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-[(4-methoxyphenyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-[(4-methoxyphenyl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-[(4-methoxyphenyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-[(4-methoxyphenyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-[(2-butyl-1H-imidazol-5-yl)methyl]-1-p-anisyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)CN2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CC=NC=C4

Isomeric SMILES

CCCCC1=NC=C(N1)CN2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CC=NC=C4

InChI

InChI=1S/C27H35N5O3/c1-3-4-5-26-29-14-23(30-26)16-31-17-25(35-20-22-10-12-28-13-11-22)18-32(27(33)19-31)15-21-6-8-24(34-2)9-7-21/h6-14,25H,3-5,15-20H2,1-2H3,(H,29,30)