(E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-(2-methylbutan-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-(2-methylbutan-2-yl)prop-2-enamide Openeye Name: (E)-N-(1,1-dimethylpropyl)-3-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-3-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-N-(2-methylbutan-2-yl)-2-propenamide IUPAC Name: (E)-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-N-(2-methylbutan-2-yl)prop-2-enamide Traditional Name: (E)-N-tert-amyl-3-(4-methoxy-3-piperidinosulfonyl-phenyl)acrylamide Formula: C20H30N2O4S MolecularWeight: 394.5282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C=CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCC(C)(C)NC(=O)/C=C/C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C20H30N2O4S/c1-5-20(2,3)21-19(23)12-10-16-9-11-17(26-4)18(15-16)27(24,25)22-13-7-6-8-14-22/h9-12,15H,5-8,13-14H2,1-4H3,(H,21,23)/b12-10+