[2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate

Systemtic Name: [2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 5-bromanylthiophene-2-carboxylate Openeye Name: [2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxo-ethyl] 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxoethyl] 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [2-[1-(3,4-dichlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C15H12BrCl2NO3S MolecularWeight: 437.13568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)NC(=O)COC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C1=CC(=C(C=C1)Cl)Cl)NC(=O)COC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C15H12BrCl2NO3S/c1-8(9-2-3-10(17)11(18)6-9)19-14(20)7-22-15(21)12-4-5-13(16)23-12/h2-6,8H,7H2,1H3,(H,19,20)