N-[3-(6-oxidanylidene-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide

Systemtic Name: N-[3-(6-oxidanylidene-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide Openeye Name: N-[3-(6-oxo-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide CAS Name: N-[3-(6-oxo-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide IUPAC Name: N-[3-(6-oxo-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide Traditional Name: N-[3-(6-keto-1,2-dihydrobenzotriazol-5-yl)propyl]-4-(2-sulfamoylphenyl)benzamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)NCCCC3=CC4=NNNC4=CC3=O)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)NCCCC3=CC4=NNNC4=CC3=O)S(=O)(=O)N

InChI

InChI=1S/C22H21N5O4S/c23-32(30,31)21-6-2-1-5-17(21)14-7-9-15(10-8-14)22(29)24-11-3-4-16-12-18-19(13-20(16)28)26-27-25-18/h1-2,5-10,12-13,26-27H,3-4,11H2,(H,24,29)(H2,23,30,31)