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

Systemtic Name: 1-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[2-oxo-2-[4-(2-pyridylmethyl)piperazin-1-yl]ethyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[2-oxo-2-[4-(2-pyridinylmethyl)-1-piperazinyl]ethyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[2-oxo-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[2-keto-2-[4-(2-pyridylmethyl)piperazino]ethyl]-4-(2-thienyl)tetrazol-5-one Formula: C17H19N7O2S MolecularWeight: 385.44346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=N2)C(=O)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=N2)C(=O)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C17H19N7O2S/c25-15(13-23-17(26)24(20-19-23)16-5-3-11-27-16)22-9-7-21(8-10-22)12-14-4-1-2-6-18-14/h1-6,11H,7-10,12-13H2