1-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[2-(4-besylpiperazino)-2-keto-ethyl]-4-(2-thienyl)tetrazol-5-one Formula: C17H18N6O4S2 MolecularWeight: 434.49262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)N(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)N(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H18N6O4S2/c24-15(13-22-17(25)23(19-18-22)16-7-4-12-28-16)20-8-10-21(11-9-20)29(26,27)14-5-2-1-3-6-14/h1-7,12H,8-11,13H2