N-[1-(2-azanyl-3-methyl-butyl)piperidin-4-yl]-1-isoquinolin-1-yl-benzimidazol-2-amine

Systemtic Name: N-[1-(2-azanyl-3-methyl-butyl)piperidin-4-yl]-1-isoquinolin-1-yl-benzimidazol-2-amine Openeye Name: N-[1-(2-amino-3-methyl-butyl)-4-piperidyl]-1-(1-isoquinolyl)benzimidazol-2-amine CAS Name: N-[1-(2-amino-3-methylbutyl)-4-piperidinyl]-1-(1-isoquinolinyl)-2-benzimidazolamine IUPAC Name: N-[1-(2-amino-3-methylbutyl)piperidin-4-yl]-1-isoquinolin-1-ylbenzimidazol-2-amine Traditional Name: [1-(2-amino-3-methyl-butyl)-4-piperidyl]-[1-(1-isoquinolyl)benzimidazol-2-yl]amine Formula: C26H32N6 MolecularWeight: 428.57248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1CCC(CC1)NC2=NC3=CC=CC=C3N2C4=NC=CC5=CC=CC=C54)N

Isomeric SMILES

CC(C)C(CN1CCC(CC1)NC2=NC3=CC=CC=C3N2C4=NC=CC5=CC=CC=C54)N

InChI

InChI=1S/C26H32N6/c1-18(2)22(27)17-31-15-12-20(13-16-31)29-26-30-23-9-5-6-10-24(23)32(26)25-21-8-4-3-7-19(21)11-14-28-25/h3-11,14,18,20,22H,12-13,15-17,27H2,1-2H3,(H,29,30)