ethyl 5-aminocarbonyl-2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(3-bromophenyl)-4,5-dihydroisoxazole-5-carbonyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[[3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]-oxomethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[3-(3-bromophenyl)-2-isoxazoline-5-carbonyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18BrN3O5S MolecularWeight: 480.33232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H18BrN3O5S/c1-3-27-19(26)14-9(2)15(16(21)24)29-18(14)22-17(25)13-8-12(23-28-13)10-5-4-6-11(20)7-10/h4-7,13H,3,8H2,1-2H3,(H2,21,24)(H,22,25)