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

Systemtic Name: methyl 2-[(6-bromanyl-2-phenyl-quinolin-4-yl)carbonylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(6-bromo-2-phenyl-4-quinolinyl)-oxomethyl]amino]-4-(3,4-dimethoxyphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid methyl ester Formula: C30H23BrN2O5S MolecularWeight: 603.48302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5)OC

InChI

InChI=1S/C30H23BrN2O5S/c1-36-25-12-9-18(13-26(25)37-2)22-16-39-29(27(22)30(35)38-3)33-28(34)21-15-24(17-7-5-4-6-8-17)32-23-11-10-19(31)14-20(21)23/h4-16H,1-3H3,(H,33,34)