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

Systemtic Name: 4-methyl-N-naphthalen-1-yl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-(1-naphthyl)-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-(1-naphthalenyl)-3-[1-[[4-[5-(3-pyridazinyl)-1-benzimidazolyl]-2-pyrimidinyl]amino]ethyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-naphthalen-1-yl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-(1-naphthyl)-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Formula: C33H32N10O MolecularWeight: 584.67358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCN1C)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)C7=NN=CC=C7

Isomeric SMILES

CC(C1CN(CCN1C)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)C7=NN=CC=C7

InChI

InChI=1S/C33H32N10O/c1-22(30-20-42(18-17-41(30)2)33(44)38-27-10-5-8-23-7-3-4-9-25(23)27)37-32-34-16-14-31(39-32)43-21-35-28-19-24(12-13-29(28)43)26-11-6-15-36-40-26/h3-16,19,21-22,30H,17-18,20H2,1-2H3,(H,38,44)(H,34,37,39)