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azepan-1-yl-[1-ethyl-5-[(5-oxidanyl-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

azepan-1-yl-[1-ethyl-5-[(5-oxidanyl-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name:azepan-1-yl-[1-ethyl-5-[(5-oxidanyl-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
Openeye Name:azepan-1-yl-[1-ethyl-5-[(5-hydroxy-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
CAS Name:1-azepanyl-[1-ethyl-5-[(5-hydroxy-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
IUPAC Name:azepan-1-yl-[1-ethyl-5-[(5-hydroxy-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
Traditional Name:azepan-1-yl-[1-ethyl-5-[(5-hydroxy-2-adamantyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
Formula: C26H40N4O2
MolecularWeight: 440.6214
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NC3C4CC5CC3CC(C5)(C4)O)C(=N1)C(=O)N6CCCCCC6


Isomeric SMILES

CCN1C2=C(CC(CC2)NC3C4CC5CC3CC(C5)(C4)O)C(=N1)C(=O)N6CCCCCC6


InChI

InChI=1S/C26H40N4O2/c1-2-30-22-8-7-20(27-23-18-11-17-12-19(23)16-26(32,14-17)15-18)13-21(22)24(28-30)25(31)29-9-5-3-4-6-10-29/h17-20,23,27,32H,2-16H2,1H3


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