1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-pyridin-3-yl-methyl]-4-phenyl-piperazine

Systemtic Name: 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-pyridin-3-yl-methyl]-4-phenyl-piperazine Openeye Name: 1-[(1-tert-butyltetrazol-5-yl)-(3-pyridyl)methyl]-4-phenyl-piperazine CAS Name: 1-[(1-tert-butyl-5-tetrazolyl)-(3-pyridinyl)methyl]-4-phenylpiperazine IUPAC Name: 1-[(1-tert-butyltetrazol-5-yl)-pyridin-3-ylmethyl]-4-phenylpiperazine Traditional Name: 1-[(1-tert-butyltetrazol-5-yl)-(3-pyridyl)methyl]-4-phenyl-piperazine Formula: C21H27N7 MolecularWeight: 377.48598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N7/c1-21(2,3)28-20(23-24-25-28)19(17-8-7-11-22-16-17)27-14-12-26(13-15-27)18-9-5-4-6-10-18/h4-11,16,19H,12-15H2,1-3H3