N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]azepane-1-sulfonamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]azepane-1-sulfonamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]azepane-1-sulfonamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-1-azepanesulfonamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]azepane-1-sulfonamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]azepane-1-sulfonamide Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNS(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H28N4O2S/c1-16-19(14-20-26(24,25)22-12-8-3-4-9-13-22)17(2)23(21-16)15-18-10-6-5-7-11-18/h5-7,10-11,20H,3-4,8-9,12-15H2,1-2H3