4-cyclopropyl-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-4-cyclopropyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]thio]-4-cyclopropyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]sulfanyl-4-cyclopropyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(4-acetylpiperazino)-2-keto-ethyl]thio]-4-cyclopropyl-1H-1,2,4-triazol-5-one Formula: C13H19N5O3S MolecularWeight: 325.38666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CSC2=NNC(=O)N2C3CC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CSC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C13H19N5O3S/c1-9(19)16-4-6-17(7-5-16)11(20)8-22-13-15-14-12(21)18(13)10-2-3-10/h10H,2-8H2,1H3,(H,14,21)