2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-N-(2-chloranyl-5-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-N-(2-chloranyl-5-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N-(2-chloro-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-N-(2-chloro-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(5-bromothiophen-2-yl)methyl-ethylamino]-N-(2-chloro-5-methylsulfonylphenyl)acetamide Traditional Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N-(2-chloro-5-mesyl-phenyl)acetamide Formula: C16H18BrClN2O3S2 MolecularWeight: 465.81272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H18BrClN2O3S2/c1-3-20(9-11-4-7-15(17)24-11)10-16(21)19-14-8-12(25(2,22)23)5-6-13(14)18/h4-8H,3,9-10H2,1-2H3,(H,19,21)