4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methyl-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methyl-pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methyl-pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methyl-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methylpyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[(2,3-diethoxyphenoxy)methyl]-5-methyl-pyrazol-1-yl]benzenesulfonamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC)OCC2=NN(C(=C2)C)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC1=CC=CC(=C1OCC)OCC2=NN(C(=C2)C)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H25N3O5S/c1-4-27-19-7-6-8-20(21(19)28-5-2)29-14-16-13-15(3)24(23-16)17-9-11-18(12-10-17)30(22,25)26/h6-13H,4-5,14H2,1-3H3,(H2,22,25,26)