(E)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-N-[(4-fluoro-3-methyl-phenyl)methyl]-3-(4-morpholinosulfonylphenyl)prop-2-enamide CAS Name: (E)-N-[(4-fluoro-3-methylphenyl)methyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[(4-fluoro-3-methylphenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(4-fluoro-3-methyl-benzyl)-3-(4-morpholinosulfonylphenyl)acrylamide Formula: C21H23FN2O4S MolecularWeight: 418.481723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C21H23FN2O4S/c1-16-14-18(4-8-20(16)22)15-23-21(25)9-5-17-2-6-19(7-3-17)29(26,27)24-10-12-28-13-11-24/h2-9,14H,10-13,15H2,1H3,(H,23,25)/b9-5+