N-[5-tert-butyl-2-(2,3-dimethylphenyl)pyrazol-3-yl]-2-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2,3-dimethylphenyl)pyrazol-3-yl]-2-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(2,3-dimethylphenyl)pyrazol-3-yl]-2-[isopropyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-[5-tert-butyl-2-(2,3-dimethylphenyl)-3-pyrazolyl]-2-[(4-methylphenyl)sulfonyl-propan-2-ylamino]acetamide IUPAC Name: N-[5-tert-butyl-2-(2,3-dimethylphenyl)pyrazol-3-yl]-2-[(4-methylphenyl)sulfonyl-propan-2-ylamino]acetamide Traditional Name: N-[5-tert-butyl-2-(2,3-dimethylphenyl)pyrazol-3-yl]-2-[isopropyl(tosyl)amino]acetamide Formula: C27H36N4O3S MolecularWeight: 496.66474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=NN2C3=CC=CC(=C3C)C)C(C)(C)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=NN2C3=CC=CC(=C3C)C)C(C)(C)C)C(C)C

InChI

InChI=1S/C27H36N4O3S/c1-18(2)30(35(33,34)22-14-12-19(3)13-15-22)17-26(32)28-25-16-24(27(6,7)8)29-31(25)23-11-9-10-20(4)21(23)5/h9-16,18H,17H2,1-8H3,(H,28,32)