propan-2-yl 2-[[4-bromanyl-2,5-bis(chloranyl)thiophen-3-yl]sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[[4-bromanyl-2,5-bis(chloranyl)thiophen-3-yl]sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(4-bromo-2,5-dichloro-3-thienyl)sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[(4-bromo-2,5-dichloro-3-thiophenyl)sulfonylamino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(4-bromo-2,5-dichlorothiophen-3-yl)sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-bromo-2,5-dichloro-3-thienyl)sulfonylamino]-4-(methylthio)butyric acid isopropyl ester Formula: C12H16BrCl2NO4S3 MolecularWeight: 485.26474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=C(SC(=C1Br)Cl)Cl

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NS(=O)(=O)C1=C(SC(=C1Br)Cl)Cl

InChI

InChI=1S/C12H16BrCl2NO4S3/c1-6(2)20-12(17)7(4-5-21-3)16-23(18,19)9-8(13)10(14)22-11(9)15/h6-7,16H,4-5H2,1-3H3