azepan-1-yl-[1-methyl-5-[4-(phenylmethyl)piperazin-1-yl]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-methyl-5-[4-(phenylmethyl)piperazin-1-yl]-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-(4-benzylpiperazin-1-yl)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-methyl-5-[4-(phenylmethyl)-1-piperazinyl]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-(4-benzylpiperazin-1-yl)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[5-(4-benzylpiperazino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C26H37N5O MolecularWeight: 435.60488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)N3CCN(CC3)CC4=CC=CC=C4)C(=N1)C(=O)N5CCCCCC5

Isomeric SMILES

CN1C2=C(CC(CC2)N3CCN(CC3)CC4=CC=CC=C4)C(=N1)C(=O)N5CCCCCC5

InChI

InChI=1S/C26H37N5O/c1-28-24-12-11-22(30-17-15-29(16-18-30)20-21-9-5-4-6-10-21)19-23(24)25(27-28)26(32)31-13-7-2-3-8-14-31/h4-6,9-10,22H,2-3,7-8,11-20H2,1H3