N-[[1-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]-2-piperidyl]methyl]methanesulfonamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCCN1C(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NCC1CCCCN1C(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3S/c1-27(25,26)21-14-18-9-5-6-12-22(18)19(24)11-10-16-13-20-23(15-16)17-7-3-2-4-8-17/h2-4,7-8,10-11,13,15,18,21H,5-6,9,12,14H2,1H3/b11-10+