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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]azepane-1-sulfonamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]azepane-1-sulfonamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-azepanesulfonamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]azepane-1-sulfonamide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNS(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H26N4O2S/c1-15-18(16(2)22(20-15)17-10-6-5-7-11-17)14-19-25(23,24)21-12-8-3-4-9-13-21/h5-7,10-11,19H,3-4,8-9,12-14H2,1-2H3