ethyl 2-[[6-bromanyl-2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[6-bromanyl-2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[6-bromo-2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[6-bromo-2-(4-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[6-bromo-2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-p-phenetyl-quinoline-4-carbonyl)amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H25BrN2O4S MolecularWeight: 553.4674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OCC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OCC)C(=O)OCC

InChI

InChI=1S/C27H25BrN2O4S/c1-4-19-14-22(27(32)34-6-3)26(35-19)30-25(31)21-15-24(16-7-10-18(11-8-16)33-5-2)29-23-12-9-17(28)13-20(21)23/h7-15H,4-6H2,1-3H3,(H,30,31)