N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: N-homopiperonyl-3-(3-keto-1,4-benzothiazin-4-yl)propionamide Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O4S/c23-19(21-9-7-14-5-6-16-17(11-14)26-13-25-16)8-10-22-15-3-1-2-4-18(15)27-12-20(22)24/h1-6,11H,7-10,12-13H2,(H,21,23)