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

Systemtic Name: 1-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[2-[4-(1-naphthylmethyl)piperazin-1-yl]-2-oxo-ethyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-2-oxoethyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-oxoethyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[2-keto-2-[4-(1-naphthylmethyl)piperazino]ethyl]-4-(2-thienyl)tetrazol-5-one Formula: C22H22N6O2S MolecularWeight: 434.51408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CN4C(=O)N(N=N4)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CN4C(=O)N(N=N4)C5=CC=CS5

InChI

InChI=1S/C22H22N6O2S/c29-20(16-27-22(30)28(24-23-27)21-9-4-14-31-21)26-12-10-25(11-13-26)15-18-7-3-6-17-5-1-2-8-19(17)18/h1-9,14H,10-13,15-16H2