1-tert-butyl-4-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-tert-butyl-4-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-tert-butyl-4-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]tetrazole-5-thione CAS Name: 1-tert-butyl-4-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-5-tetrazolethione IUPAC Name: 1-tert-butyl-4-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]tetrazole-5-thione Traditional Name: 1-tert-butyl-4-[(4-p-phenetylsulfonylpiperazino)methyl]tetrazole-5-thione Formula: C18H28N6O3S2 MolecularWeight: 440.58332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=S)N(N=N3)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=S)N(N=N3)C(C)(C)C

InChI

InChI=1S/C18H28N6O3S2/c1-5-27-15-6-8-16(9-7-15)29(25,26)22-12-10-21(11-13-22)14-23-17(28)24(20-19-23)18(2,3)4/h6-9H,5,10-14H2,1-4H3