1-(2-chlorophenyl)-4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(2-chlorophenyl)-4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]-1,2,3,4-tetrazol-5-one Openeye Name: 1-(2-chlorophenyl)-4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]tetrazol-5-one CAS Name: 1-(2-chlorophenyl)-4-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-5-tetrazolone IUPAC Name: 1-(2-chlorophenyl)-4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]tetrazol-5-one Traditional Name: 1-(2-chlorophenyl)-4-[[4-(2-thenoyl)piperazino]methyl]tetrazol-5-one Formula: C17H17ClN6O2S MolecularWeight: 404.87388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)N(N=N2)C3=CC=CC=C3Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CN2C(=O)N(N=N2)C3=CC=CC=C3Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C17H17ClN6O2S/c18-13-4-1-2-5-14(13)24-17(26)23(19-20-24)12-21-7-9-22(10-8-21)16(25)15-6-3-11-27-15/h1-6,11H,7-10,12H2