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

Systemtic Name: 4-[4-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-pyridin-4-yl-methyl]piperazin-1-yl]phenol Openeye Name: 4-[4-[(1-tert-butyltetrazol-5-yl)-(4-pyridyl)methyl]piperazin-1-yl]phenol CAS Name: 4-[4-[(1-tert-butyl-5-tetrazolyl)-pyridin-4-ylmethyl]-1-piperazinyl]phenol IUPAC Name: 4-[4-[(1-tert-butyltetrazol-5-yl)-pyridin-4-ylmethyl]piperazin-1-yl]phenol Traditional Name: 4-[4-[(1-tert-butyltetrazol-5-yl)-(4-pyridyl)methyl]piperazino]phenol Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N7O/c1-21(2,3)28-20(23-24-25-28)19(16-8-10-22-11-9-16)27-14-12-26(13-15-27)17-4-6-18(29)7-5-17/h4-11,19,29H,12-15H2,1-3H3