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

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]-2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[5-(2-thienyl)tetrazol-2-yl]ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(5-thiophen-2-yl-2-tetrazolyl)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(5-thiophen-2-yltetrazol-2-yl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-[5-(2-thienyl)tetrazol-2-yl]ethanone Formula: C17H18N6O3S2 MolecularWeight: 418.49322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2N=C(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2N=C(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H18N6O3S2/c24-16(13-23-19-17(18-20-23)15-7-4-12-27-15)21-8-10-22(11-9-21)28(25,26)14-5-2-1-3-6-14/h1-7,12H,8-11,13H2