[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-1-oxopropan-2-yl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (2-keto-1-methyl-2-ureido-ethyl) ester Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

CC(C(=O)NC(=O)N)OC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C13H13N3O5S/c1-6(11(18)16-13(14)20)21-12(19)7-2-3-9-8(4-7)15-10(17)5-22-9/h2-4,6H,5H2,1H3,(H,15,17)(H3,14,16,18,20)