(E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(1-methylsulfonyl-4-piperidyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(1-methylsulfonyl-4-piperidinyl)-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(1-methylsulfonylpiperidin-4-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(1-mesyl-4-piperidyl)-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C18H22N4O3S MolecularWeight: 374.45728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O3S/c1-26(24,25)21-11-9-16(10-12-21)20-18(23)8-7-15-13-19-22(14-15)17-5-3-2-4-6-17/h2-8,13-14,16H,9-12H2,1H3,(H,20,23)/b8-7+