N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-1-azepanesulfonamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]azepane-1-sulfonamide Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H24N4O2S/c1-19(24(22,23)20-11-7-2-3-8-12-20)14-16-13-18-21(15-16)17-9-5-4-6-10-17/h4-6,9-10,13,15H,2-3,7-8,11-12,14H2,1H3