methyl 3-(5-azanylquinolin-8-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(5-azanylquinolin-8-yl)sulfanylpropanoate Openeye Name: methyl 3-[(5-amino-8-quinolyl)sulfanyl]propanoate CAS Name: 3-[(5-amino-8-quinolinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(5-aminoquinolin-8-yl)sulfanylpropanoate Traditional Name: 3-[(5-amino-8-quinolyl)thio]propionic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C2C(=C(C=C1)N)C=CC=N2

Isomeric SMILES

COC(=O)CCSC1=C2C(=C(C=C1)N)C=CC=N2

InChI

InChI=1S/C13H14N2O2S/c1-17-12(16)6-8-18-11-5-4-10(14)9-3-2-7-15-13(9)11/h2-5,7H,6,8,14H2,1H3