N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-4-methylsulfonyl-benzamide Openeye Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-4-methylsulfonyl-benzamide CAS Name: N-[2-[(4-tert-butylphenyl)methyl]-3-pyrazolyl]-4-methylsulfonylbenzamide IUPAC Name: N-[2-[(4-tert-butylphenyl)methyl]pyrazol-3-yl]-4-methylsulfonylbenzamide Traditional Name: N-[2-(4-tert-butylbenzyl)pyrazol-3-yl]-4-mesyl-benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H25N3O3S/c1-22(2,3)18-9-5-16(6-10-18)15-25-20(13-14-23-25)24-21(26)17-7-11-19(12-8-17)29(4,27)28/h5-14H,15H2,1-4H3,(H,24,26)