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

Systemtic Name: 1-adamantyl-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methanone Openeye Name: 1-adamantyl-[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methanone CAS Name: 1-adamantyl-[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methanone IUPAC Name: 1-adamantyl-(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methanone Traditional Name: 1-adamantyl-(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methanone Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C23CC4CC(C2)CC(C4)C3)C)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C(C(=NN1C(=O)C23CC4CC(C2)CC(C4)C3)C)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C21H31N3O3S/c1-14-19(28(26,27)23-6-4-3-5-7-23)15(2)24(22-14)20(25)21-11-16-8-17(12-21)10-18(9-16)13-21/h16-18H,3-13H2,1-2H3