3-[1-[[4-(5-azanylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 3-[1-[[4-(5-azanylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 3-[1-[[4-(5-amino-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-phenylpiperidine-1-carboxamide Traditional Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-phenyl-piperidine-1-carboxamide Formula: C25H28N8O MolecularWeight: 456.54282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN(C1)C(=O)NC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=C4C=CC(=C5)N

Isomeric SMILES

CC(C1CCCN(C1)C(=O)NC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=C4C=CC(=C5)N

InChI

InChI=1S/C25H28N8O/c1-17(18-6-5-13-32(15-18)25(34)30-20-7-3-2-4-8-20)29-24-27-12-11-23(31-24)33-16-28-21-14-19(26)9-10-22(21)33/h2-4,7-12,14,16-18H,5-6,13,15,26H2,1H3,(H,30,34)(H,27,29,31)