N-tert-butyl-5-[4-(methylsulfonylaminomethyl)phenyl]-1-pyridin-3-yl-pyrazole-3-carboxamide

Systemtic Name: N-tert-butyl-5-[4-(methylsulfonylaminomethyl)phenyl]-1-pyridin-3-yl-pyrazole-3-carboxamide Openeye Name: N-tert-butyl-5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridyl)pyrazole-3-carboxamide CAS Name: N-tert-butyl-5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridinyl)-3-pyrazolecarboxamide IUPAC Name: N-tert-butyl-5-[4-(methanesulfonamidomethyl)phenyl]-1-pyridin-3-ylpyrazole-3-carboxamide Traditional Name: N-tert-butyl-5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridyl)pyrazole-3-carboxamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNS(=O)(=O)C)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNS(=O)(=O)C)C3=CN=CC=C3

InChI

InChI=1S/C21H25N5O3S/c1-21(2,3)24-20(27)18-12-19(26(25-18)17-6-5-11-22-14-17)16-9-7-15(8-10-16)13-23-30(4,28)29/h5-12,14,23H,13H2,1-4H3,(H,24,27)