(E)-N-(4-methoxy-3-sulfamoyl-phenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(4-methoxy-3-sulfamoyl-phenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)prop-2-enamide CAS Name: (E)-N-(4-methoxy-3-sulfamoylphenyl)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)acrylamide Formula: C20H20N4O4S MolecularWeight: 412.4622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C=CC2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C=C/C2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C20H20N4O4S/c1-28-18-9-8-17(11-19(18)29(21,26)27)23-20(25)10-7-16-12-22-24(14-16)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3,(H,23,25)(H2,21,26,27)/b10-7+