N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-3-phenoxy-benzamide

Systemtic Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-3-phenoxy-benzamide Openeye Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]-3-phenoxy-benzamide CAS Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridinyl]methyl]-3-phenoxybenzamide IUPAC Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-3-phenoxybenzamide Traditional Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]-3-phenoxy-benzamide Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CN1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c1-28-13-6-14-29(16-15-28)24-12-11-20(18-26-24)19-27-25(30)21-7-5-10-23(17-21)31-22-8-3-2-4-9-22/h2-5,7-12,17-18H,6,13-16,19H2,1H3,(H,27,30)