2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C15H21N7OS MolecularWeight: 347.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C15H21N7OS/c1-12(2)22-11-18-19-15(22)24-10-13(23)20-6-8-21(9-7-20)14-16-4-3-5-17-14/h3-5,11-12H,6-10H2,1-2H3