1-(4-methylsulfonylpiperazin-1-yl)-2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-methylsulfonyl-1-piperazinyl)-2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-mesylpiperazino)-2-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C15H21N5O3S3 MolecularWeight: 415.55394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C)CC3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C)CC3=CC=CS3

InChI

InChI=1S/C15H21N5O3S3/c1-18-13(10-12-4-3-9-24-12)16-17-15(18)25-11-14(21)19-5-7-20(8-6-19)26(2,22)23/h3-4,9H,5-8,10-11H2,1-2H3