3-methoxy-N-[6-[4-(phenylmethyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC4=CC=CC=C4

InChI

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