methyl 2-[(4-chloranylthieno[3,2-c]quinolin-2-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-chloranylthieno[3,2-c]quinolin-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-chlorothieno[3,2-c]quinoline-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-chloro-2-thieno[3,2-c]quinolinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-chlorothieno[3,2-c]quinoline-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-chlorothieno[3,2-c]quinoline-2-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC2=C(S1)C3=CC=CC=C3N=C2Cl

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=CC2=C(S1)C3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C18H17ClN2O3S2/c1-24-18(23)13(7-8-25-2)21-17(22)14-9-11-15(26-14)10-5-3-4-6-12(10)20-16(11)19/h3-6,9,13H,7-8H2,1-2H3,(H,21,22)