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

Systemtic Name: N-naphthalen-1-yl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Openeye Name: N-(1-naphthyl)-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide CAS Name: N-(1-naphthalenyl)-3-[1-[[4-[5-(3-pyridazinyl)-1-benzimidazolyl]-2-pyrimidinyl]amino]ethyl]-1-piperidinecarboxamide IUPAC Name: N-naphthalen-1-yl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Traditional Name: N-(1-naphthyl)-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Formula: C33H31N9O MolecularWeight: 569.65894

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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)C7=NN=CC=C7

Isomeric SMILES

CC(C1CCCN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)C7=NN=CC=C7

InChI

InChI=1S/C33H31N9O/c1-22(25-9-6-18-41(20-25)33(43)38-28-11-4-8-23-7-2-3-10-26(23)28)37-32-34-17-15-31(39-32)42-21-35-29-19-24(13-14-30(29)42)27-12-5-16-36-40-27/h2-5,7-8,10-17,19,21-22,25H,6,9,18,20H2,1H3,(H,38,43)(H,34,37,39)