N-[3-[4-[(E)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]sulfanylphenyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[3-[4-[(E)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]sulfanylphenyl]-1-phenyl-methanesulfonamide Openeye Name: N-[3-[4-[(E)-3-morpholino-3-oxo-prop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]sulfanylphenyl]-1-phenyl-methanesulfonamide CAS Name: N-[3-[[4-[(E)-3-(4-morpholinyl)-3-oxoprop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]thio]phenyl]-1-phenylmethanesulfonamide IUPAC Name: N-[3-[4-[(E)-3-morpholin-4-yl-3-oxoprop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]sulfanylphenyl]-1-phenylmethanesulfonamide Traditional Name: N-[3-[[4-[(E)-3-keto-3-morpholino-prop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]thio]phenyl]-1-phenyl-methanesulfonamide Formula: C28H24F6N2O4S2 MolecularWeight: 630.621579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C=CC2=C(C(=C(C=C2)SC3=CC=CC(=C3)NS(=O)(=O)CC4=CC=CC=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1COCCN1C(=O)/C=C/C2=C(C(=C(C=C2)SC3=CC=CC(=C3)NS(=O)(=O)CC4=CC=CC=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C28H24F6N2O4S2/c29-27(30,31)25-20(10-12-24(37)36-13-15-40-16-14-36)9-11-23(26(25)28(32,33)34)41-22-8-4-7-21(17-22)35-42(38,39)18-19-5-2-1-3-6-19/h1-12,17,35H,13-16,18H2/b12-10+