(2-oxidanylidenechromen-7-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate Openeye Name: (2-oxochromen-7-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]acetic acid (2-ketochromen-7-yl) ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3)C

InChI

InChI=1S/C17H14N2O4S/c1-10-7-11(2)19-17(18-10)24-9-16(21)22-13-5-3-12-4-6-15(20)23-14(12)8-13/h3-8H,9H2,1-2H3