1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[3-(1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanone

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[3-(1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanone Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[3-(tetrazol-2-yl)-1-adamantyl]ethanone CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-2-[3-(2-tetrazolyl)-1-adamantyl]ethanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[3-(tetrazol-2-yl)-1-adamantyl]ethanone Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-2-[3-(tetrazol-2-yl)-1-adamantyl]ethanone Formula: C24H32N6O2 MolecularWeight: 436.54988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)(C4)N6N=CN=N6

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)(C4)N6N=CN=N6

InChI

InChI=1S/C24H32N6O2/c1-32-21-4-2-20(3-5-21)28-6-8-29(9-7-28)22(31)15-23-11-18-10-19(12-23)14-24(13-18,16-23)30-26-17-25-27-30/h2-5,17-19H,6-16H2,1H3