N-[5-(1,4-diazepan-1-ylcarbonyl)-2-(4-pyridin-3-ylcarbonyl-1,4-diazepan-1-yl)phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-2-(4-pyridin-3-ylcarbonyl-1,4-diazepan-1-yl)phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-[4-[oxo(3-pyridinyl)methyl]-1,4-diazepan-1-yl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-2-(4-nicotinoyl-1,4-diazepan-1-yl)phenyl]-3,4-dimethoxy-benzamide Formula: C32H38N6O5 MolecularWeight: 586.68132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)C5=CN=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)N4CCCN(CC4)C(=O)C5=CN=CC=C5)OC

InChI

InChI=1S/C32H38N6O5/c1-42-28-10-8-23(21-29(28)43-2)30(39)35-26-20-24(31(40)37-14-4-12-33-13-17-37)7-9-27(26)36-15-5-16-38(19-18-36)32(41)25-6-3-11-34-22-25/h3,6-11,20-22,33H,4-5,12-19H2,1-2H3,(H,35,39)