N-[2-(4-cyclohexylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[2-(4-cyclohexylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]pyridine-3-carboxamide Openeye Name: N-[2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]pyridine-3-carboxamide CAS Name: N-[2-[4-[cyclohexyl(oxo)methyl]-1-piperazinyl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]pyridine-3-carboxamide Traditional Name: N-[2-[4-(cyclohexanecarbonyl)piperazino]-5-(1,4-diazepane-1-carbonyl)phenyl]nicotinamide Formula: C29H38N6O3 MolecularWeight: 518.65042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C29H38N6O3/c36-27(24-8-4-11-31-21-24)32-25-20-23(29(38)34-14-5-12-30-13-15-34)9-10-26(25)33-16-18-35(19-17-33)28(37)22-6-2-1-3-7-22/h4,8-11,20-22,30H,1-3,5-7,12-19H2,(H,32,36)