[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid [2-(2-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid [2-(2-bromoanilino)-2-keto-ethyl] ester Formula: C16H15BrN2O4S MolecularWeight: 411.2703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=CS2)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=CS2)Br

InChI

InChI=1S/C16H15BrN2O4S/c17-11-4-1-2-5-12(11)19-14(20)10-23-15(21)7-8-18-16(22)13-6-3-9-24-13/h1-6,9H,7-8,10H2,(H,18,22)(H,19,20)