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

Systemtic Name: 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-pyridin-4-yl-methyl]-4-(2,3-dimethylphenyl)piperazine Openeye Name: 1-[(1-tert-butyltetrazol-5-yl)-(4-pyridyl)methyl]-4-(2,3-dimethylphenyl)piperazine CAS Name: 1-[(1-tert-butyl-5-tetrazolyl)-pyridin-4-ylmethyl]-4-(2,3-dimethylphenyl)piperazine IUPAC Name: 1-[(1-tert-butyltetrazol-5-yl)-pyridin-4-ylmethyl]-4-(2,3-dimethylphenyl)piperazine Traditional Name: 1-[(1-tert-butyltetrazol-5-yl)-(4-pyridyl)methyl]-4-(2,3-dimethylphenyl)piperazine Formula: C23H31N7 MolecularWeight: 405.53914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=NC=C3)C4=NN=NN4C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(C3=CC=NC=C3)C4=NN=NN4C(C)(C)C)C

InChI

InChI=1S/C23H31N7/c1-17-7-6-8-20(18(17)2)28-13-15-29(16-14-28)21(19-9-11-24-12-10-19)22-25-26-27-30(22)23(3,4)5/h6-12,21H,13-16H2,1-5H3