2-(1-adamantyl)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(1-adamantyl)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 2-(1-adamantyl)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(1-adamantyl)-1-[4-(1-azepanylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1-adamantyl)-1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethanone Traditional Name: 2-(1-adamantyl)-1-[4-(azepan-1-ylsulfonyl)piperazino]ethanone Formula: C22H37N3O3S MolecularWeight: 423.61248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H37N3O3S/c26-21(17-22-14-18-11-19(15-22)13-20(12-18)16-22)23-7-9-25(10-8-23)29(27,28)24-5-3-1-2-4-6-24/h18-20H,1-17H2