(E)-3-(6-tert-butylpyridin-3-yl)-N-[[3-ethenyl-4-(methylsulfonylamino)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(6-tert-butylpyridin-3-yl)-N-[[3-ethenyl-4-(methylsulfonylamino)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(6-tert-butyl-3-pyridyl)-N-[[4-(methanesulfonamido)-3-vinyl-phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(6-tert-butyl-3-pyridinyl)-N-[[3-ethenyl-4-(methanesulfonamido)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(6-tert-butylpyridin-3-yl)-N-[[3-ethenyl-4-(methanesulfonamido)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(6-tert-butyl-3-pyridyl)-N-[4-(methanesulfonamido)-3-vinyl-benzyl]acrylamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=C1)C=CC(=O)NCC2=CC(=C(C=C2)NS(=O)(=O)C)C=C

Isomeric SMILES

CC(C)(C)C1=NC=C(C=C1)/C=C/C(=O)NCC2=CC(=C(C=C2)NS(=O)(=O)C)C=C

InChI

InChI=1S/C22H27N3O3S/c1-6-18-13-17(7-10-19(18)25-29(5,27)28)15-24-21(26)12-9-16-8-11-20(23-14-16)22(2,3)4/h6-14,25H,1,15H2,2-5H3,(H,24,26)/b12-9+