(4-pyrazol-1-ylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]-2-propenoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]acrylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)OCC2=CC=C(C=C2)N3C=CC=N3)OC

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)/C=C/C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)OC

InChI

InChI=1S/C21H21N3O5S/c1-22-30(26,27)20-14-16(6-10-19(20)28-2)7-11-21(25)29-15-17-4-8-18(9-5-17)24-13-3-12-23-24/h3-14,22H,15H2,1-2H3/b11-7+