(E)-3-(2-fluorophenyl)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(2-fluorophenyl)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(2-fluorophenyl)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-3-(2-fluorophenyl)-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(2-fluorophenyl)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(2-fluorophenyl)-N-(2-methyl-5-piperidinosulfonyl-phenyl)acrylamide Formula: C21H23FN2O3S MolecularWeight: 402.482323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C=CC3=CC=CC=C3F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)/C=C/C3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O3S/c1-16-9-11-18(28(26,27)24-13-5-2-6-14-24)15-20(16)23-21(25)12-10-17-7-3-4-8-19(17)22/h3-4,7-12,15H,2,5-6,13-14H2,1H3,(H,23,25)/b12-10+