3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-naphthalen-1-yl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide

Systemtic Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-naphthalen-1-yl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Openeye Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(1-naphthyl)-4-(4-pyridylmethyl)piperazine-1-carboxamide CAS Name: 3-[1-[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-N-(1-naphthalenyl)-4-(pyridin-4-ylmethyl)-1-piperazinecarboxamide IUPAC Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-naphthalen-1-yl-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Traditional Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-N-(1-naphthyl)-4-(4-pyridylmethyl)piperazine-1-carboxamide Formula: C34H33N9O MolecularWeight: 583.68552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=CC=CC4=CC=CC=C43)NC5=NC=CC(=N5)N6C=NC7=CC=CC=C76

Isomeric SMILES

CC(C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=CC=CC4=CC=CC=C43)NC5=NC=CC(=N5)N6C=NC7=CC=CC=C76

InChI

InChI=1S/C34H33N9O/c1-24(38-33-36-18-15-32(40-33)43-23-37-29-10-4-5-12-30(29)43)31-22-42(20-19-41(31)21-25-13-16-35-17-14-25)34(44)39-28-11-6-8-26-7-2-3-9-27(26)28/h2-18,23-24,31H,19-22H2,1H3,(H,39,44)(H,36,38,40)