2-(4-methylpiperazin-1-yl)carbonyl-3-(2-methylsulfanylpyrimidin-4-yl)-1,2-oxazol-5-one

Systemtic Name: 2-(4-methylpiperazin-1-yl)carbonyl-3-(2-methylsulfanylpyrimidin-4-yl)-1,2-oxazol-5-one Openeye Name: 2-(4-methylpiperazine-1-carbonyl)-3-(2-methylsulfanylpyrimidin-4-yl)isoxazol-5-one CAS Name: 2-[(4-methyl-1-piperazinyl)-oxomethyl]-3-[2-(methylthio)-4-pyrimidinyl]-5-isoxazolone IUPAC Name: 2-(4-methylpiperazine-1-carbonyl)-3-(2-methylsulfanylpyrimidin-4-yl)-1,2-oxazol-5-one Traditional Name: 2-(4-methylpiperazine-1-carbonyl)-3-[2-(methylthio)pyrimidin-4-yl]-3-isoxazolin-5-one Formula: C14H17N5O3S MolecularWeight: 335.38148

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)N2C(=CC(=O)O2)C3=NC(=NC=C3)SC

Isomeric SMILES

CN1CCN(CC1)C(=O)N2C(=CC(=O)O2)C3=NC(=NC=C3)SC

InChI

InChI=1S/C14H17N5O3S/c1-17-5-7-18(8-6-17)14(21)19-11(9-12(20)22-19)10-3-4-15-13(16-10)23-2/h3-4,9H,5-8H2,1-2H3