(E)-3-(4-cyanophenyl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(4-cyanophenyl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-cyanophenyl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-cyanophenyl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-cyanophenyl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-cyanophenyl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)acrylamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)C#N)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC=C(C=C2)C#N)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H23N3O3S/c1-17-5-11-20(15-21(17)29(27,28)25-13-3-2-4-14-25)24-22(26)12-10-18-6-8-19(16-23)9-7-18/h5-12,15H,2-4,13-14H2,1H3,(H,24,26)/b12-10+