methyl 2-[2-[methyl-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[methyl-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[methyl-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]acetyl]amino]benzoate CAS Name: 2-[[2-[methyl-[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[methyl-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]acetyl]amino]benzoate Traditional Name: 2-[[2-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1C(=O)OC)C(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1C(=O)OC)C(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C20H19N3O5S/c1-23(10-17(24)21-14-6-4-3-5-13(14)20(27)28-2)19(26)12-7-8-16-15(9-12)22-18(25)11-29-16/h3-9H,10-11H2,1-2H3,(H,21,24)(H,22,25)