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

Systemtic Name: ethyl 2-[[6-bromanyl-2-(4-ethoxyphenyl)quinolin-4-yl]carbonylamino]-5-propyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[6-bromo-2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[[6-bromo-2-(4-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-5-propyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[6-bromo-2-(4-ethoxyphenyl)quinoline-4-carbonyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-p-phenetyl-quinoline-4-carbonyl)amino]-5-propyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H27BrN2O4S MolecularWeight: 567.49398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OCC)C(=O)OCC

Isomeric SMILES

CCCC1=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/C28H27BrN2O4S/c1-4-7-20-15-23(28(33)35-6-3)27(36-20)31-26(32)22-16-25(17-8-11-19(12-9-17)34-5-2)30-24-13-10-18(29)14-21(22)24/h8-16H,4-7H2,1-3H3,(H,31,32)