methyl 3-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methyl-benzoate

Systemtic Name: methyl 3-[[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methyl-benzoate Openeye Name: methyl 3-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methyl-benzoate CAS Name: 3-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methylbenzoate Traditional Name: 3-[[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]sulfamoyl]-4-methyl-benzoic acid methyl ester Formula: C17H15ClN4O4S MolecularWeight: 406.8434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

InChI

InChI=1S/C17H15ClN4O4S/c1-11-3-4-12(17(23)26-2)7-16(11)27(24,25)21-14-8-13(18)5-6-15(14)22-10-19-9-20-22/h3-10,21H,1-2H3