1,3-benzodioxol-5-yl-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methanone

Systemtic Name: 1,3-benzodioxol-5-yl-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methanone Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC3=C(C=C2)OCO3)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC3=C(C=C2)OCO3)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C18H21N3O5S/c1-12-17(27(23,24)20-8-4-3-5-9-20)13(2)21(19-12)18(22)14-6-7-15-16(10-14)26-11-25-15/h6-7,10H,3-5,8-9,11H2,1-2H3