N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methylbenzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-5-(cyclohexylsulfamoyl)-2-methyl-benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CCCCC2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CCCCC2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C22H25N3O3S/c1-16-7-12-20(29(27,28)25-19-5-3-2-4-6-19)15-21(16)22(26)24-18-10-8-17(9-11-18)13-14-23/h7-12,15,19,25H,2-6,13H2,1H3,(H,24,26)