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

Systemtic Name: methyl 5-ethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[2-[4-(2-methylpropyl)phenyl]-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C28H28N2O3S MolecularWeight: 472.59852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C(=O)OC

InChI

InChI=1S/C28H28N2O3S/c1-5-20-15-23(28(32)33-4)27(34-20)30-26(31)22-16-25(29-24-9-7-6-8-21(22)24)19-12-10-18(11-13-19)14-17(2)3/h6-13,15-17H,5,14H2,1-4H3,(H,30,31)