(2-benzamido-2-oxidanylidene-ethyl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]acetic acid (2-benzamido-2-keto-ethyl) ester Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H17N3O4S/c1-11-8-12(2)19-17(18-11)25-10-15(22)24-9-14(21)20-16(23)13-6-4-3-5-7-13/h3-8H,9-10H2,1-2H3,(H,20,21,23)