N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-(3-oxidanylidene-1-phenyl-butan-2-yl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-(1-benzyl-2-oxo-propyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-(3-oxo-1-phenylbutan-2-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-(3-oxo-1-phenylbutan-2-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-(1-benzyl-2-keto-propyl)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)NC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C19H18N2O5S/c1-13(22)16(11-14-7-3-2-4-8-14)20-18(23)12-21-19(24)15-9-5-6-10-17(15)27(21,25)26/h2-10,16H,11-12H2,1H3,(H,20,23)