(E)-2-cyano-3-[1-(phenylmethyl)pyrazol-4-yl]-N-(4-sulfamoylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(phenylmethyl)pyrazol-4-yl]-N-(4-sulfamoylphenyl)prop-2-enamide Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-2-cyano-N-(4-sulfamoylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(phenylmethyl)-4-pyrazolyl]-N-(4-sulfamoylphenyl)-2-propenamide IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-2-cyano-N-(4-sulfamoylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-2-cyano-N-(4-sulfamoylphenyl)acrylamide Formula: C20H17N5O3S MolecularWeight: 407.44568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=C(C#N)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H17N5O3S/c21-11-17(20(26)24-18-6-8-19(9-7-18)29(22,27)28)10-16-12-23-25(14-16)13-15-4-2-1-3-5-15/h1-10,12,14H,13H2,(H,24,26)(H2,22,27,28)/b17-10+