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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)C(C)C)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)C(C)C)C(=O)OC

InChI

InChI=1S/C27H25BrN2O4S/c1-5-34-18-9-6-16(7-10-18)23-13-20(19-12-17(28)8-11-22(19)29-23)25(31)30-26-21(27(32)33-4)14-24(35-26)15(2)3/h6-15H,5H2,1-4H3,(H,30,31)