ethyl 2-[[(4-bromophenyl)sulfonyl-cyclopropyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-bromophenyl)sulfonyl-cyclopropyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-bromophenyl)sulfonyl-cyclopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-bromophenyl)sulfonyl-cyclopropylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-bromophenyl)sulfonyl-cyclopropylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[brosyl(cyclopropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C16H17BrN2O4S2 MolecularWeight: 445.35118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C2CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C2CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H17BrN2O4S2/c1-2-23-16(20)14-10-24-15(18-14)9-19(12-5-6-12)25(21,22)13-7-3-11(17)4-8-13/h3-4,7-8,10,12H,2,5-6,9H2,1H3