(E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-pyridin-4-yl-prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-pyridin-4-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-[3-(1-piperidylsulfonyl)phenyl]-3-(4-pyridyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[3-(1-piperidinylsulfonyl)phenyl]-3-pyridin-4-yl-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-pyridin-4-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-(3-piperidinosulfonylphenyl)-3-(4-pyridyl)acrylamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C(=CC3=CC=NC=C3)C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)/C(=C/C3=CC=NC=C3)/C#N

InChI

InChI=1S/C20H20N4O3S/c21-15-17(13-16-7-9-22-10-8-16)20(25)23-18-5-4-6-19(14-18)28(26,27)24-11-2-1-3-12-24/h4-10,13-14H,1-3,11-12H2,(H,23,25)/b17-13+