4-[1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine

Systemtic Name: 4-[1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine Openeye Name: 4-[1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine CAS Name: 4-[[1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-3,5-dimethylpyrazol-4-yl]sulfonylmorpholine Traditional Name: 4-[1-(4-tert-butyl-2,6-dimethyl-benzyl)-3,5-dimethyl-pyrazol-4-yl]sulfonylmorpholine Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CN2C(=C(C(=N2)C)S(=O)(=O)N3CCOCC3)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CN2C(=C(C(=N2)C)S(=O)(=O)N3CCOCC3)C)C)C(C)(C)C

InChI

InChI=1S/C22H33N3O3S/c1-15-12-19(22(5,6)7)13-16(2)20(15)14-25-18(4)21(17(3)23-25)29(26,27)24-8-10-28-11-9-24/h12-13H,8-11,14H2,1-7H3