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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C30H23BrN2O3S/c1-18-8-10-20(11-9-18)27-17-24(23-15-21(31)12-13-26(23)32-27)28(34)33-29-25(30(35)36-2)16-22(37-29)14-19-6-4-3-5-7-19/h3-13,15-17H,14H2,1-2H3,(H,33,34)