2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)-N-phenethyl-ethanamide Openeye Name: 2-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]-N-phenethyl-acetamide CAS Name: 2-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]-N-phenethylacetamide IUPAC Name: 2-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)-N-phenethylacetamide Traditional Name: 2-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)-N-phenethyl-acetamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCCC2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCCC2=CC=CC=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H28N4O3S/c1-16-20(28(26,27)23-13-7-4-8-14-23)17(2)24(22-16)15-19(25)21-12-11-18-9-5-3-6-10-18/h3,5-6,9-10H,4,7-8,11-15H2,1-2H3,(H,21,25)