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

Systemtic Name: N-naphthalen-1-yl-3-[1-[[4-[5-(pyrrolidin-2-ylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Openeye Name: N-(1-naphthyl)-3-[1-[[4-[5-(pyrrolidin-2-ylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide CAS Name: N-(1-naphthalenyl)-3-[1-[[4-[5-(2-pyrrolidinylmethylamino)-1-benzimidazolyl]-2-pyrimidinyl]amino]ethyl]-1-piperidinecarboxamide IUPAC Name: N-naphthalen-1-yl-3-[1-[[4-[5-(pyrrolidin-2-ylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Traditional Name: N-(1-naphthyl)-3-[1-[[4-[5-(pyrrolidin-2-ylmethylamino)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperidine-1-carboxamide Formula: C34H39N9O MolecularWeight: 589.73316

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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)NCC7CCCN7

Isomeric SMILES

CC(C1CCCN(C1)C(=O)NC2=CC=CC3=CC=CC=C32)NC4=NC=CC(=N4)N5C=NC6=C5C=CC(=C6)NCC7CCCN7

InChI

InChI=1S/C34H39N9O/c1-23(25-9-6-18-42(21-25)34(44)40-29-12-4-8-24-7-2-3-11-28(24)29)39-33-36-17-15-32(41-33)43-22-38-30-19-26(13-14-31(30)43)37-20-27-10-5-16-35-27/h2-4,7-8,11-15,17,19,22-23,25,27,35,37H,5-6,9-10,16,18,20-21H2,1H3,(H,40,44)(H,36,39,41)