methyl 3-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methylsulfamoyl]benzoate

Systemtic Name: methyl 3-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methylsulfamoyl]benzoate Openeye Name: methyl 3-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methylsulfamoyl]benzoate CAS Name: 3-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methylsulfamoyl]benzoate Traditional Name: 3-[[2-(1,2,4-triazol-1-ylmethyl)benzyl]sulfamoyl]benzoic acid methyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2CN3C=NC=N3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2CN3C=NC=N3

InChI

InChI=1S/C18H18N4O4S/c1-26-18(23)14-7-4-8-17(9-14)27(24,25)21-10-15-5-2-3-6-16(15)11-22-13-19-12-20-22/h2-9,12-13,21H,10-11H2,1H3