N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]isoquinoline-3-carboxamide

Systemtic Name: N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]isoquinoline-3-carboxamide Openeye Name: N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]isoquinoline-3-carboxamide CAS Name: N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]-3-isoquinolinecarboxamide IUPAC Name: N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]isoquinoline-3-carboxamide Traditional Name: N-[3-[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]propyl]isoquinoline-3-carboxamide Formula: C30H30N6O MolecularWeight: 490.5988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C=CC=N2)N(CCCNC(=O)C3=CC4=CC=CC=C4C=N3)CC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1CC(C2=C(C1)C=CC=N2)N(CCCNC(=O)C3=CC4=CC=CC=C4C=N3)CC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C30H30N6O/c37-30(26-18-22-8-1-2-9-23(22)19-33-26)32-16-7-17-36(20-28-34-24-12-3-4-13-25(24)35-28)27-14-5-10-21-11-6-15-31-29(21)27/h1-4,6,8-9,11-13,15,18-19,27H,5,7,10,14,16-17,20H2,(H,32,37)(H,34,35)