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

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

C1CC(CN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)CCNC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)N

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)CCNC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)N

InChI

InChI=1S/C29H30N8O/c30-22-10-11-26-25(17-22)33-19-37(26)27-13-15-32-28(35-27)31-14-12-20-5-4-16-36(18-20)29(38)34-24-9-3-7-21-6-1-2-8-23(21)24/h1-3,6-11,13,15,17,19-20H,4-5,12,14,16,18,30H2,(H,34,38)(H,31,32,35)