ethyl (2S)-2-[(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: ethyl (2S)-2-[(4-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-3-methyl-butanoate Openeye Name: ethyl (2S)-2-[(4-bromo-5-chloro-2-thienyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[(4-bromo-5-chloro-2-thiophenyl)sulfonylamino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(4-bromo-5-chlorothiophen-2-yl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-bromo-5-chloro-2-thienyl)sulfonylamino]-3-methyl-butyric acid ethyl ester Formula: C11H15BrClNO4S2 MolecularWeight: 404.7281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)NS(=O)(=O)C1=CC(=C(S1)Cl)Br

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)NS(=O)(=O)C1=CC(=C(S1)Cl)Br

InChI

InChI=1S/C11H15BrClNO4S2/c1-4-18-11(15)9(6(2)3)14-20(16,17)8-5-7(12)10(13)19-8/h5-6,9,14H,4H2,1-3H3/t9-/m0/s1