2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C13H17N7OS2 MolecularWeight: 351.45038

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CNC1=NN=C(S1)SCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C13H17N7OS2/c1-14-12-17-18-13(23-12)22-9-10(21)19-5-7-20(8-6-19)11-15-3-2-4-16-11/h2-4H,5-9H2,1H3,(H,14,17)