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

Systemtic Name: 3-[1-[[4-(5-azanylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-naphthalen-1-yl-piperidine-1-carboxamide Openeye Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(1-naphthyl)piperidine-1-carboxamide CAS Name: 3-[1-[[4-(5-amino-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-N-(1-naphthalenyl)-1-piperidinecarboxamide IUPAC Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-naphthalen-1-ylpiperidine-1-carboxamide Traditional Name: 3-[1-[[4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(1-naphthyl)piperidine-1-carboxamide Formula: C29H30N8O MolecularWeight: 506.6015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)N

Isomeric SMILES

CC(C1CCCN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)N

InChI

InChI=1S/C29H30N8O/c1-19(33-28-31-14-13-27(35-28)37-18-32-25-16-22(30)11-12-26(25)37)21-8-5-15-36(17-21)29(38)34-24-10-4-7-20-6-2-3-9-23(20)24/h2-4,6-7,9-14,16,18-19,21H,5,8,15,17,30H2,1H3,(H,34,38)(H,31,33,35)