N-[6-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-methoxy-benzamide

Systemtic Name: N-[6-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-methoxy-benzamide Openeye Name: N-[6-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-methoxy-benzamide CAS Name: N-[6-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]-3-methoxybenzamide IUPAC Name: N-[6-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-methoxybenzamide Traditional Name: N-[6-[4-(2-fluorobenzyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-methoxy-benzamide Formula: C25H27FN4O2 MolecularWeight: 434.505883

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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=C4F

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC4=CC=CC=C4F

InChI

InChI=1S/C25H27FN4O2/c1-32-22-8-4-7-19(16-22)25(31)28-21-10-11-24(27-17-21)30-13-5-12-29(14-15-30)18-20-6-2-3-9-23(20)26/h2-4,6-11,16-17H,5,12-15,18H2,1H3,(H,28,31)