(E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-isopropylphenyl)-N-[3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-[3-(1-piperidinylsulfonyl)phenyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-piperidin-1-ylsulfonylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-p-cumenyl-N-(3-piperidinosulfonylphenyl)acrylamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H27N3O3S/c1-18(2)20-11-9-19(10-12-20)15-21(17-25)24(28)26-22-7-6-8-23(16-22)31(29,30)27-13-4-3-5-14-27/h6-12,15-16,18H,3-5,13-14H2,1-2H3,(H,26,28)/b21-15+