1-(2,3-dimethylphenyl)-4-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-(2,3-dimethylphenyl)-4-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-(2,3-dimethylphenyl)-4-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]tetrazole-5-thione CAS Name: 1-(2,3-dimethylphenyl)-4-[[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-5-tetrazolethione IUPAC Name: 1-(2,3-dimethylphenyl)-4-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]tetrazole-5-thione Traditional Name: 1-(2,3-dimethylphenyl)-4-[(4-p-anisylpiperazino)methyl]tetrazole-5-thione Formula: C22H28N6OS MolecularWeight: 424.56232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=S)N(N=N2)CN3CCN(CC3)CC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=S)N(N=N2)CN3CCN(CC3)CC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C22H28N6OS/c1-17-5-4-6-21(18(17)2)28-22(30)27(23-24-28)16-26-13-11-25(12-14-26)15-19-7-9-20(29-3)10-8-19/h4-10H,11-16H2,1-3H3