N-(4-bromanyl-2-methyl-phenyl)-2-[2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-(3-oxo-1,4-benzothiazin-4-yl)acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[1-oxo-2-(3-oxo-1,4-benzothiazin-4-yl)ethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-(3-oxo-1,4-benzothiazin-4-yl)acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-(3-keto-1,4-benzothiazin-4-yl)acetyl]amino]acetamide Formula: C19H18BrN3O3S MolecularWeight: 448.33352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C19H18BrN3O3S/c1-12-8-13(20)6-7-14(12)22-17(24)9-21-18(25)10-23-15-4-2-3-5-16(15)27-11-19(23)26/h2-8H,9-11H2,1H3,(H,21,25)(H,22,24)