4-(1-adamantyl)-3,5-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-pyrazole

Systemtic Name: 4-(1-adamantyl)-3,5-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-pyrazole Openeye Name: 4-(1-adamantyl)-3,5-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-pyrazole CAS Name: 4-(1-adamantyl)-3,5-dimethyl-1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]pyrazole IUPAC Name: 4-(1-adamantyl)-3,5-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpyrazole Traditional Name: 4-(1-adamantyl)-3,5-dimethyl-1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-pyrazole Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=C(N(N=C2C)C)C)C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=C(N(N=C2C)C)C)C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H30N4O2S/c1-12-19(21-9-16-6-17(10-21)8-18(7-16)11-21)14(3)25(23-12)28(26,27)20-13(2)22-24(5)15(20)4/h16-18H,6-11H2,1-5H3