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

Systemtic Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidin-1-yl]-N,N-diphenyl-piperidine-1-carboxamide Openeye Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-piperidyl]-N,N-diphenyl-piperidine-1-carboxamide CAS Name: 4-[2-[[4-(1-azepanyl)-2-pyrimidinyl]amino]-1-piperidinyl]-N,N-diphenyl-1-piperidinecarboxamide IUPAC Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidin-1-yl]-N,N-diphenylpiperidine-1-carboxamide Traditional Name: 4-[2-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]piperidino]-N,N-diphenyl-piperidine-1-carboxamide Formula: C33H43N7O MolecularWeight: 553.74082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCCN3C4CCN(CC4)C(=O)N(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCCN3C4CCN(CC4)C(=O)N(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H43N7O/c41-33(40(28-13-5-3-6-14-28)29-15-7-4-8-16-29)38-25-19-27(20-26-38)39-24-12-9-17-31(39)36-32-34-21-18-30(35-32)37-22-10-1-2-11-23-37/h3-8,13-16,18,21,27,31H,1-2,9-12,17,19-20,22-26H2,(H,34,35,36)