2-[4-[[3-[di(cyclobutyl)amino]pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[[3-[di(cyclobutyl)amino]pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[[3-[di(cyclobutyl)amino]pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[[3-[di(cyclobutyl)amino]-1-pyrrolidinyl]methyl]phenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[[3-[di(cyclobutyl)amino]pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[[3-[di(cyclobutyl)amino]pyrrolidino]methyl]phenyl]-1H-benzimidazole-4-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N(C2CCC2)C3CCN(C3)CC4=CC=C(C=C4)C5=NC6=C(C=CC=C6N5)C(=O)N

Isomeric SMILES

C1CC(C1)N(C2CCC2)C3CCN(C3)CC4=CC=C(C=C4)C5=NC6=C(C=CC=C6N5)C(=O)N

InChI

InChI=1S/C27H33N5O/c28-26(33)23-8-3-9-24-25(23)30-27(29-24)19-12-10-18(11-13-19)16-31-15-14-22(17-31)32(20-4-1-5-20)21-6-2-7-21/h3,8-13,20-22H,1-2,4-7,14-17H2,(H2,28,33)(H,29,30)