1-ethyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[[4-(isopropylsulfamoylmethyl)phenyl]methyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[4-(isopropylsulfamoylmethyl)benzyl]benzotriazole-5-carboxamide Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC(C)C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC(C)C)N=N1

InChI

InChI=1S/C20H25N5O3S/c1-4-25-19-10-9-17(11-18(19)22-24-25)20(26)21-12-15-5-7-16(8-6-15)13-29(27,28)23-14(2)3/h5-11,14,23H,4,12-13H2,1-3H3,(H,21,26)