methyl 5-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]furan-2-carboxylic acid methyl ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OC)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)OC)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H23N3O5S/c1-12-16(26(22,23)19-9-5-4-6-10-19)13(2)20(18-12)11-14-7-8-15(25-14)17(21)24-3/h7-8H,4-6,9-11H2,1-3H3