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

Systemtic Name: methyl 5-[(1-ethyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(1-ethyl-4-oxo-quinoline-3-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[(1-ethyl-4-oxo-3-quinolinyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(1-ethyl-4-oxoquinoline-3-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(1-ethyl-4-keto-quinoline-3-carbonyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC=CC=C21)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC=CC=C21)C(=O)NC3=CC4=C(C=C3)SC(=C4)C(=O)OC

InChI

InChI=1S/C22H18N2O4S/c1-3-24-12-16(20(25)15-6-4-5-7-17(15)24)21(26)23-14-8-9-18-13(10-14)11-19(29-18)22(27)28-2/h4-12H,3H2,1-2H3,(H,23,26)