2-[3-oxidanylidene-6-[[2-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]ethanoic acid

Systemtic Name: 2-[3-oxidanylidene-6-[[2-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]ethanoic acid Openeye Name: 2-[3-oxo-6-[[2-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid CAS Name: 2-[3-oxo-6-[[2-(1-pyrazolylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-[3-oxo-6-[[2-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid Traditional Name: 2-[3-keto-6-[[2-(pyrazol-1-ylmethyl)phenyl]sulfamoyl]-1,4-benzoxazin-4-yl]acetic acid Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3CN4C=CC=N4)CC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3CN4C=CC=N4)CC(=O)O

InChI

InChI=1S/C20H18N4O6S/c25-19-13-30-18-7-6-15(10-17(18)24(19)12-20(26)27)31(28,29)22-16-5-2-1-4-14(16)11-23-9-3-8-21-23/h1-10,22H,11-13H2,(H,26,27)