2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H21N5O2S/c1-12-14(13(2)23-19-12)10-24-11-15(22)20-6-8-21(9-7-20)16-17-4-3-5-18-16/h3-5H,6-11H2,1-2H3