8-(4-ethoxy-5-methyl-pyrimidin-2-yl)sulfanylquinoline-5-carboxylic acid

Systemtic Name: 8-(4-ethoxy-5-methyl-pyrimidin-2-yl)sulfanylquinoline-5-carboxylic acid Openeye Name: 8-(4-ethoxy-5-methyl-pyrimidin-2-yl)sulfanylquinoline-5-carboxylic acid CAS Name: 8-[(4-ethoxy-5-methyl-2-pyrimidinyl)thio]-5-quinolinecarboxylic acid IUPAC Name: 8-(4-ethoxy-5-methylpyrimidin-2-yl)sulfanylquinoline-5-carboxylic acid Traditional Name: 8-[(4-ethoxy-5-methyl-pyrimidin-2-yl)thio]quinoline-5-carboxylic acid Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1C)SC2=C3C(=C(C=C2)C(=O)O)C=CC=N3

Isomeric SMILES

CCOC1=NC(=NC=C1C)SC2=C3C(=C(C=C2)C(=O)O)C=CC=N3

InChI

InChI=1S/C17H15N3O3S/c1-3-23-15-10(2)9-19-17(20-15)24-13-7-6-12(16(21)22)11-5-4-8-18-14(11)13/h4-9H,3H2,1-2H3,(H,21,22)