N-[3,5-bis(trifluoromethyl)phenyl]-3-(5-bromanylthiophen-2-yl)sulfonyl-propanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(5-bromanylthiophen-2-yl)sulfonyl-propanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-[(5-bromo-2-thienyl)sulfonyl]propanamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-[(5-bromo-2-thiophenyl)sulfonyl]propanamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(5-bromothiophen-2-yl)sulfonylpropanamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-[(5-bromo-2-thienyl)sulfonyl]propionamide Formula: C15H10BrF6NO3S2 MolecularWeight: 510.269219

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)S(=O)(=O)CCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=C(SC(=C1)Br)S(=O)(=O)CCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H10BrF6NO3S2/c16-11-1-2-13(27-11)28(25,26)4-3-12(24)23-10-6-8(14(17,18)19)5-9(7-10)15(20,21)22/h1-2,5-7H,3-4H2,(H,23,24)