4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidin-1-yl]-N,N-dibutyl-piperidine-1-carboxamide

Systemtic Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidin-1-yl]-N,N-dibutyl-piperidine-1-carboxamide Openeye Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-piperidyl]-N,N-dibutyl-piperidine-1-carboxamide CAS Name: 4-[2-[[4-(1-azepanyl)-2-pyrimidinyl]amino]-1-piperidinyl]-N,N-dibutyl-1-piperidinecarboxamide IUPAC Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidin-1-yl]-N,N-dibutylpiperidine-1-carboxamide Traditional Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidino]-N,N-dibutyl-piperidine-1-carboxamide Formula: C29H51N7O MolecularWeight: 513.76154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)N1CCC(CC1)N2CCCCC2NC3=NC=CC(=N3)N4CCCCCC4

Isomeric SMILES

CCCCN(CCCC)C(=O)N1CCC(CC1)N2CCCCC2NC3=NC=CC(=N3)N4CCCCCC4

InChI

InChI=1S/C29H51N7O/c1-3-5-18-34(19-6-4-2)29(37)35-23-15-25(16-24-35)36-22-12-9-13-27(36)32-28-30-17-14-26(31-28)33-20-10-7-8-11-21-33/h14,17,25,27H,3-13,15-16,18-24H2,1-2H3,(H,30,31,32)