methyl 5-[(6-chloranyl-1-ethyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(6-chloranyl-1-ethyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(6-chloro-1-ethyl-4-oxo-quinoline-3-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[(6-chloro-1-ethyl-4-oxo-3-quinolinyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(6-chloro-1-ethyl-4-oxoquinoline-3-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(6-chloro-1-ethyl-4-keto-quinoline-3-carbonyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C22H17ClN2O4S MolecularWeight: 440.89938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)Cl)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)Cl)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

InChI

InChI=1S/C22H17ClN2O4S/c1-3-25-11-16(20(26)15-10-13(23)4-6-17(15)25)21(27)24-14-5-7-18-12(8-14)9-19(30-18)22(28)29-2/h4-11H,3H2,1-2H3,(H,24,27)