1-[2-[1-(2-ethyl-6-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]-2-adamantyl]piperazine

Systemtic Name: 1-[2-[1-(2-ethyl-6-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]-2-adamantyl]piperazine Openeye Name: 1-[2-[1-(2-ethyl-6-methyl-phenyl)tetrazol-5-yl]-2-adamantyl]piperazine CAS Name: 1-[2-[1-(2-ethyl-6-methylphenyl)-5-tetrazolyl]-2-adamantyl]piperazine IUPAC Name: 1-[2-[1-(2-ethyl-6-methylphenyl)tetrazol-5-yl]-2-adamantyl]piperazine Traditional Name: 1-[2-[1-(2-ethyl-6-methyl-phenyl)tetrazol-5-yl]-2-adamantyl]piperazine Formula: C24H34N6 MolecularWeight: 406.56696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N2C(=NN=N2)C3(C4CC5CC(C4)CC3C5)N6CCNCC6)C

Isomeric SMILES

CCC1=CC=CC(=C1N2C(=NN=N2)C3(C4CC5CC(C4)CC3C5)N6CCNCC6)C

InChI

InChI=1S/C24H34N6/c1-3-19-6-4-5-16(2)22(19)30-23(26-27-28-30)24(29-9-7-25-8-10-29)20-12-17-11-18(14-20)15-21(24)13-17/h4-6,17-18,20-21,25H,3,7-15H2,1-2H3