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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-ethoxy-N-methyl-benzenesulfonamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-ethoxy-N-methyl-benzenesulfonamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-4-ethoxy-N-methylbenzenesulfonamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-4-ethoxy-N-methylbenzenesulfonamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-4-ethoxy-N-methyl-benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O3S/c1-5-27-19-11-13-20(14-12-19)28(25,26)23(4)15-21-16(2)22-24(17(21)3)18-9-7-6-8-10-18/h6-14H,5,15H2,1-4H3