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

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O5S/c1-7(2)12(13(20)18-15(16)22)23-14(21)8-3-4-10-9(5-8)17-11(19)6-24-10/h3-5,7,12H,6H2,1-2H3,(H,17,19)(H3,16,18,20,22)