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

Systemtic Name: N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]pyridine-3-carboxamide Openeye Name: N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]pyridine-3-carboxamide CAS Name: N-[2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]pyridine-3-carboxamide Traditional Name: N-[2-[4-(cyclobutanecarbonyl)piperazino]-5-(1,4-diazepane-1-carbonyl)phenyl]nicotinamide Formula: C27H34N6O3 MolecularWeight: 490.59726

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C27H34N6O3/c34-25(22-6-2-9-29-19-22)30-23-18-21(27(36)32-12-3-10-28-11-13-32)7-8-24(23)31-14-16-33(17-15-31)26(35)20-4-1-5-20/h2,6-9,18-20,28H,1,3-5,10-17H2,(H,30,34)