N'-[3,5-bis(trifluoromethyl)phenyl]sulfonylthiomorpholine-4-carboximidamide

Systemtic Name: N'-[3,5-bis(trifluoromethyl)phenyl]sulfonylthiomorpholine-4-carboximidamide Openeye Name: N'-[3,5-bis(trifluoromethyl)phenyl]sulfonylthiomorpholine-4-carboxamidine CAS Name: N'-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-thiomorpholinecarboximidamide IUPAC Name: N'-[3,5-bis(trifluoromethyl)phenyl]sulfonylthiomorpholine-4-carboximidamide Traditional Name: N'-[3,5-bis(trifluoromethyl)phenyl]sulfonylthiomorpholine-4-carboxamidine Formula: C13H13F6N3O2S2 MolecularWeight: 421.381639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N

Isomeric SMILES

C1CSCCN1/C(=N/S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)/N

InChI

InChI=1S/C13H13F6N3O2S2/c14-12(15,16)8-5-9(13(17,18)19)7-10(6-8)26(23,24)21-11(20)22-1-3-25-4-2-22/h5-7H,1-4H2,(H2,20,21)