6-butyl-N5-(phenylmethyl)-7-piperidin-4-yl-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazole-2,5-diamine

Systemtic Name: 6-butyl-N5-(phenylmethyl)-7-piperidin-4-yl-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazole-2,5-diamine Openeye Name: N5-benzyl-6-butyl-7-(4-piperidyl)-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazole-2,5-diamine CAS Name: 6-butyl-N5-(phenylmethyl)-7-(4-piperidinyl)-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazole-2,5-diamine IUPAC Name: 5-N-benzyl-6-butyl-7-piperidin-4-yl-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazole-2,5-diamine Traditional Name: [2-amino-6-butyl-7-(4-piperidyl)-3-(1,2,3,4-tetrahydroquinolin-8-yl)benzimidazol-5-yl]-benzyl-amine Formula: C32H40N6 MolecularWeight: 508.7002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1C3CCNCC3)N=C(N2C4=CC=CC5=C4NCCC5)N)NCC6=CC=CC=C6

Isomeric SMILES

CCCCC1=C(C=C2C(=C1C3CCNCC3)N=C(N2C4=CC=CC5=C4NCCC5)N)NCC6=CC=CC=C6

InChI

InChI=1S/C32H40N6/c1-2-3-13-25-26(36-21-22-9-5-4-6-10-22)20-28-31(29(25)23-15-18-34-19-16-23)37-32(33)38(28)27-14-7-11-24-12-8-17-35-30(24)27/h4-7,9-11,14,20,23,34-36H,2-3,8,12-13,15-19,21H2,1H3,(H2,33,37)