3-oxidanylidene-N-[3-(pyrazol-1-ylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: 3-oxidanylidene-N-[3-(pyrazol-1-ylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: 3-oxo-N-[3-(pyrazol-1-ylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide CAS Name: 3-oxo-N-[3-(1-pyrazolylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: 3-oxo-N-[3-(pyrazol-1-ylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[3-(pyrazol-1-ylmethyl)phenyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)CN4C=CC=N4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)CN4C=CC=N4

InChI

InChI=1S/C18H16N4O4S/c23-18-12-26-17-6-5-15(10-16(17)20-18)27(24,25)21-14-4-1-3-13(9-14)11-22-8-2-7-19-22/h1-10,21H,11-12H2,(H,20,23)