4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]benzamide

Systemtic Name: 4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]benzamide Openeye Name: 4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]benzamide CAS Name: 4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]benzamide IUPAC Name: 4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]benzamide Traditional Name: 4-(2-cyanoethylsulfamoyl)-N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]benzamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)C

InChI

InChI=1S/C21H21N5O3S/c1-15-14-16(2)26(25-15)20-7-4-3-6-19(20)24-21(27)17-8-10-18(11-9-17)30(28,29)23-13-5-12-22/h3-4,6-11,14,23H,5,13H2,1-2H3,(H,24,27)