[5-[4-(2-adamantyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [5-[4-(2-adamantyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-yl-methanone Openeye Name: [5-[4-(2-adamantyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-(1-piperidyl)methanone CAS Name: [5-[4-(2-adamantyl)-1-piperazinyl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-(1-piperidinyl)methanone IUPAC Name: [5-[4-(2-adamantyl)piperazin-1-yl]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-piperidin-1-ylmethanone Traditional Name: [5-[4-(2-adamantyl)piperazino]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-piperidino-methanone Formula: C28H43N5O MolecularWeight: 465.67392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)N3CCN(CC3)C4C5CC6CC(C5)CC4C6)C(=N1)C(=O)N7CCCCC7

Isomeric SMILES

CN1C2=C(CC(CC2)N3CCN(CC3)C4C5CC6CC(C5)CC4C6)C(=N1)C(=O)N7CCCCC7

InChI

InChI=1S/C28H43N5O/c1-30-25-6-5-23(18-24(25)26(29-30)28(34)33-7-3-2-4-8-33)31-9-11-32(12-10-31)27-21-14-19-13-20(16-21)17-22(27)15-19/h19-23,27H,2-18H2,1H3