N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H23N5O3S/c1-25(2)30(28,29)17-8-9-19-18(14-17)24-20(26(19)3)10-11-21(27)23-16-6-4-15(5-7-16)12-13-22/h4-9,14H,10-12H2,1-3H3,(H,23,27)