methyl 3-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[[4-(cyclopropylcarbamoyl)-2-quinolyl]sulfanyl]propanoate CAS Name: 3-[[4-[(cyclopropylamino)-oxomethyl]-2-quinolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylpropanoate Traditional Name: 3-[[4-(cyclopropylcarbamoyl)-2-quinolyl]thio]propionic acid methyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3

Isomeric SMILES

COC(=O)CCSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3

InChI

InChI=1S/C17H18N2O3S/c1-22-16(20)8-9-23-15-10-13(17(21)18-11-6-7-11)12-4-2-3-5-14(12)19-15/h2-5,10-11H,6-9H2,1H3,(H,18,21)