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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H28N4O2S/c1-16-19(17(2)23(20-16)18-11-7-6-8-12-18)15-21(3)26(24,25)22-13-9-4-5-10-14-22/h6-8,11-12H,4-5,9-10,13-15H2,1-3H3