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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butane-1-sulfonamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butane-1-sulfonamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-butanesulfonamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]butane-1-sulfonamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butane-1-sulfonamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCCS(=O)(=O)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C16H23N3O2S/c1-4-5-11-22(20,21)17-12-16-13(2)18-19(14(16)3)15-9-7-6-8-10-15/h6-10,17H,4-5,11-12H2,1-3H3