(E)-N-(4-bromanyl-2-methyl-phenyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-bromanyl-2-methyl-phenyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-bromo-2-methyl-phenyl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: (E)-N-(4-bromo-2-methylphenyl)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-bromo-2-methylphenyl)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(4-bromo-2-methyl-phenyl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylamide Formula: C21H23BrN2O5S MolecularWeight: 495.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C=CC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)/C=C/C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H23BrN2O5S/c1-15-13-17(22)5-6-18(15)23-21(25)8-4-16-3-7-19(28-2)20(14-16)30(26,27)24-9-11-29-12-10-24/h3-8,13-14H,9-12H2,1-2H3,(H,23,25)/b8-4+