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

Systemtic Name: ethyl 2-[(6-bromanyl-2-phenyl-quinolin-4-yl)carbonylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-phenyl-4-quinolinyl)-oxomethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C30H23BrN2O3S MolecularWeight: 571.48422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C30H23BrN2O3S/c1-3-36-30(35)27-26(20-12-8-5-9-13-20)18(2)37-29(27)33-28(34)23-17-25(19-10-6-4-7-11-19)32-24-15-14-21(31)16-22(23)24/h4-17H,3H2,1-2H3,(H,33,34)