N-[2-[3-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-cyclohexyl-piperidin-2-yl]ethyl]piperidine-2-carboxamide

Systemtic Name: N-[2-[3-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-cyclohexyl-piperidin-2-yl]ethyl]piperidine-2-carboxamide Openeye Name: N-[2-[3-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-cyclohexyl-2-piperidyl]ethyl]piperidine-2-carboxamide CAS Name: N-[2-[3-[[4-(1-azepanyl)-2-pyrimidinyl]amino]-1-cyclohexyl-2-piperidinyl]ethyl]-2-piperidinecarboxamide IUPAC Name: N-[2-[3-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-cyclohexylpiperidin-2-yl]ethyl]piperidine-2-carboxamide Traditional Name: N-[2-[3-[[4-(azepan-1-yl)pyrimidin-2-yl]amino]-1-cyclohexyl-2-piperidyl]ethyl]pipecolinamide Formula: C29H49N7O MolecularWeight: 511.74566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCN(C3CCNC(=O)C4CCCCN4)C5CCCCC5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCN(C3CCNC(=O)C4CCCCN4)C5CCCCC5

InChI

InChI=1S/C29H49N7O/c37-28(25-13-6-7-17-30-25)31-18-15-26-24(14-10-22-36(26)23-11-4-3-5-12-23)33-29-32-19-16-27(34-29)35-20-8-1-2-9-21-35/h16,19,23-26,30H,1-15,17-18,20-22H2,(H,31,37)(H,32,33,34)