2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-1-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-1-(4-pyrrolidinosulfonylpiperazino)ethanone Formula: C15H26N6O3S2 MolecularWeight: 402.53534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C15H26N6O3S2/c1-2-5-13-16-17-15(25)21(13)12-14(22)18-8-10-20(11-9-18)26(23,24)19-6-3-4-7-19/h2-12H2,1H3,(H,17,25)