5-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-[[4-(4-chlorophenyl)-1-piperazinyl]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-[[4-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-[[4-(4-chlorophenyl)piperazino]sulfonylmethyl]-1,2-dihydro-1,2,4-triazol-3-one Formula: C13H16ClN5O3S MolecularWeight: 357.81584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)CC3=NC(=O)NN3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)CC3=NC(=O)NN3

InChI

InChI=1S/C13H16ClN5O3S/c14-10-1-3-11(4-2-10)18-5-7-19(8-6-18)23(21,22)9-12-15-13(20)17-16-12/h1-4H,5-9H2,(H2,15,16,17,20)