1-[(1-methylpyrazol-4-yl)methyl]-4-(4-phenylphenyl)carbonyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-(4-phenylphenyl)carbonyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-(4-phenylbenzoyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(1-methyl-4-pyrazolyl)methyl]-4-[oxo-(4-phenylphenyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-(4-phenylbenzoyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-[(1-methylpyrazol-4-yl)methyl]-4-(4-phenylbenzoyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C29H29N5O3 MolecularWeight: 495.57226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)OCC5=CC=NC=C5

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)OCC5=CC=NC=C5

InChI

InChI=1S/C29H29N5O3/c1-32-16-23(15-31-32)17-33-18-27(37-21-22-11-13-30-14-12-22)19-34(20-28(33)35)29(36)26-9-7-25(8-10-26)24-5-3-2-4-6-24/h2-16,27H,17-21H2,1H3