2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]-N-(1H-benzimidazol-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]-N-(1H-benzimidazol-2-ylmethyl)ethanamide Openeye Name: 2-[4-[4-(aminomethyl)-1-piperidyl]-6-oxo-pyridazin-1-yl]-N-(1H-benzimidazol-2-ylmethyl)acetamide CAS Name: 2-[4-[4-(aminomethyl)-1-piperidinyl]-6-oxo-1-pyridazinyl]-N-(1H-benzimidazol-2-ylmethyl)acetamide IUPAC Name: 2-[4-[4-(aminomethyl)piperidin-1-yl]-6-oxopyridazin-1-yl]-N-(1H-benzimidazol-2-ylmethyl)acetamide Traditional Name: 2-[4-[4-(aminomethyl)piperidino]-6-keto-pyridazin-1-yl]-N-(1H-benzimidazol-2-ylmethyl)acetamide Formula: C20H25N7O2 MolecularWeight: 395.4582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CC(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CC(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H25N7O2/c21-10-14-5-7-26(8-6-14)15-9-20(29)27(23-11-15)13-19(28)22-12-18-24-16-3-1-2-4-17(16)25-18/h1-4,9,11,14H,5-8,10,12-13,21H2,(H,22,28)(H,24,25)