N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3-keto-1,4-benzothiazin-4-yl)propionamide Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CCN3C(=O)CSC4=CC=CC=C43)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CCN3C(=O)CSC4=CC=CC=C43)OCO2

InChI

InChI=1S/C20H18N2O5S/c1-12(23)13-8-16-17(27-11-26-16)9-14(13)21-19(24)6-7-22-15-4-2-3-5-18(15)28-10-20(22)25/h2-5,8-9H,6-7,10-11H2,1H3,(H,21,24)