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

Systemtic Name: 3-[2-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-cyclohexyl-piperidine-1-carboxamide Openeye Name: 3-[2-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-cyclohexyl-piperidine-1-carboxamide CAS Name: 3-[2-[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-N-cyclohexyl-1-piperidinecarboxamide IUPAC Name: 3-[2-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-cyclohexylpiperidine-1-carboxamide Traditional Name: 3-[2-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-cyclohexyl-piperidine-1-carboxamide Formula: C25H33N7O MolecularWeight: 447.57582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCC(C2)CCNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCCC(C2)CCNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H33N7O/c33-25(29-20-8-2-1-3-9-20)31-16-6-7-19(17-31)12-14-26-24-27-15-13-23(30-24)32-18-28-21-10-4-5-11-22(21)32/h4-5,10-11,13,15,18-20H,1-3,6-9,12,14,16-17H2,(H,29,33)(H,26,27,30)