N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[[2-(isopropylsulfamoylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[2-(isopropylsulfamoylmethyl)benzyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H25N5O3S/c1-16(2)25-30(28,29)13-20-6-4-3-5-19(20)11-23-21(27)18-9-7-17(8-10-18)12-26-15-22-14-24-26/h3-10,14-16,25H,11-13H2,1-2H3,(H,23,27)