2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-oxidanylidene-1,3-benzothiazin-2-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-oxidanylidene-1,3-benzothiazin-2-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-oxo-1,3-benzothiazin-2-yl)acetamide Traditional Name: N-(4-keto-1,3-benzothiazin-2-yl)-2-(4-piperonylpiperazino)acetamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=NC(=O)C5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=NC(=O)C5=CC=CC=C5S4

InChI

InChI=1S/C22H22N4O4S/c27-20(23-22-24-21(28)16-3-1-2-4-19(16)31-22)13-26-9-7-25(8-10-26)12-15-5-6-17-18(11-15)30-14-29-17/h1-6,11H,7-10,12-14H2,(H,23,24,27,28)