N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)-N-piperonyl-acetamide Formula: C19H18N2O4S MolecularWeight: 370.42222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CSC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18N2O4S/c22-18(20-10-13-5-6-15-16(9-13)25-12-24-15)11-21-14-3-1-2-4-17(14)26-8-7-19(21)23/h1-6,9H,7-8,10-12H2,(H,20,22)