N-(2-imidazol-1-ylethyl)-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-(2-imidazol-1-ylethyl)-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[2-(1-imidazolyl)ethyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-(2-imidazol-1-ylethyl)-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: N-(2-imidazol-1-ylethyl)-3-keto-4H-1,4-benzoxazine-6-sulfonamide Formula: C13H14N4O4S MolecularWeight: 322.33966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCN3C=CN=C3

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCN3C=CN=C3

InChI

InChI=1S/C13H14N4O4S/c18-13-8-21-12-2-1-10(7-11(12)16-13)22(19,20)15-4-6-17-5-3-14-9-17/h1-3,5,7,9,15H,4,6,8H2,(H,16,18)