(4-tert-butylphenyl)-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)methanone

Systemtic Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)methanone Openeye Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-pyrazol-1-yl)methanone CAS Name: (4-tert-butylphenyl)-[3,5-dimethyl-4-(1-pyrrolidinylsulfonyl)-1-pyrazolyl]methanone IUPAC Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonylpyrazol-1-yl)methanone Traditional Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-pyrrolidinosulfonyl-pyrazol-1-yl)methanone Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)C(C)(C)C)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)C(C)(C)C)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H27N3O3S/c1-14-18(27(25,26)22-12-6-7-13-22)15(2)23(21-14)19(24)16-8-10-17(11-9-16)20(3,4)5/h8-11H,6-7,12-13H2,1-5H3