1-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-(phenylmethyl)piperazine

Systemtic Name: 1-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[(4-methoxyphenyl)-[1-(2-thienylmethyl)tetrazol-5-yl]methyl]piperazine CAS Name: 1-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[(4-methoxyphenyl)-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]methyl]piperazine Traditional Name: 1-benzyl-4-[(4-methoxyphenyl)-[1-(2-thenyl)tetrazol-5-yl]methyl]piperazine Formula: C25H28N6OS MolecularWeight: 460.59442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=NN=NN2CC3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=NN=NN2CC3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H28N6OS/c1-32-22-11-9-21(10-12-22)24(25-26-27-28-31(25)19-23-8-5-17-33-23)30-15-13-29(14-16-30)18-20-6-3-2-4-7-20/h2-12,17,24H,13-16,18-19H2,1H3