methyl 2-[4-(1-methylimidazol-2-yl)carbonylquinolin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[4-(1-methylimidazol-2-yl)carbonylquinolin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]sulfanyl]acetate CAS Name: 2-[[4-[(1-methyl-2-imidazolyl)-oxomethyl]-2-quinolinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-(1-methylimidazole-2-carbonyl)quinolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(1-methylimidazole-2-carbonyl)-2-quinolyl]thio]acetic acid methyl ester Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)OC

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)OC

InChI

InChI=1S/C17H15N3O3S/c1-20-8-7-18-17(20)16(22)12-9-14(24-10-15(21)23-2)19-13-6-4-3-5-11(12)13/h3-9H,10H2,1-2H3