azepan-1-yl-[1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-propyl-5-(2-pyridylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-propyl-5-(2-pyridinylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[1-propyl-5-(pyridin-2-ylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-propyl-5-(2-pyridylmethylamino)-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C23H33N5O MolecularWeight: 395.54102

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)NCC3=CC=CC=N3)C(=N1)C(=O)N4CCCCCC4

Isomeric SMILES

CCCN1C2=C(CC(CC2)NCC3=CC=CC=N3)C(=N1)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H33N5O/c1-2-13-28-21-11-10-18(25-17-19-9-5-6-12-24-19)16-20(21)22(26-28)23(29)27-14-7-3-4-8-15-27/h5-6,9,12,18,25H,2-4,7-8,10-11,13-17H2,1H3