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

Systemtic Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-(2H-1,2,3,4-tetrazol-5-yl)phenyl]piperazine Openeye Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-(2H-tetrazol-5-yl)phenyl]piperazine CAS Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-(2H-tetrazol-5-yl)phenyl]piperazine IUPAC Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-(2H-tetrazol-5-yl)phenyl]piperazine Traditional Name: 1-butyl-4-[2-(4-tert-butylcyclohexyl)-5-(2H-tetrazol-5-yl)phenyl]piperazine Formula: C25H40N6 MolecularWeight: 424.6253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C3=NNN=N3)C4CCC(CC4)C(C)(C)C

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=CC(=C2)C3=NNN=N3)C4CCC(CC4)C(C)(C)C

InChI

InChI=1S/C25H40N6/c1-5-6-13-30-14-16-31(17-15-30)23-18-20(24-26-28-29-27-24)9-12-22(23)19-7-10-21(11-8-19)25(2,3)4/h9,12,18-19,21H,5-8,10-11,13-17H2,1-4H3,(H,26,27,28,29)