4-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethylsulfonyl]piperazin-2-one

Systemtic Name: 4-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethylsulfonyl]piperazin-2-one Openeye Name: 4-[2-(5-phenyltetrazol-2-yl)ethylsulfonyl]piperazin-2-one CAS Name: 4-[2-(5-phenyl-2-tetrazolyl)ethylsulfonyl]-2-piperazinone IUPAC Name: 4-[2-(5-phenyltetrazol-2-yl)ethylsulfonyl]piperazin-2-one Traditional Name: 4-[2-(5-phenyltetrazol-2-yl)ethylsulfonyl]piperazin-2-one Formula: C13H16N6O3S MolecularWeight: 336.36954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)CCN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)CCN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C13H16N6O3S/c20-12-10-18(7-6-14-12)23(21,22)9-8-19-16-13(15-17-19)11-4-2-1-3-5-11/h1-5H,6-10H2,(H,14,20)