ethyl 2-[3-[(4-bromophenyl)carbonylamino]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-[(4-bromophenyl)carbonylamino]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[[(4-bromophenyl)-oxomethyl]amino]-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21BrN2O4S MolecularWeight: 453.35004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-4-26-19(25)16-11(2)12(3)27-18(16)22-15(23)9-10-21-17(24)13-5-7-14(20)8-6-13/h5-8H,4,9-10H2,1-3H3,(H,21,24)(H,22,23)