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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(furan-2-yl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-furyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-furanyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(furan-2-yl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Traditional Name: 2-[2-(2-furyl)-4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-piperonyl-acetamide Formula: C23H20N2O5S MolecularWeight: 436.4803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CO5

Isomeric SMILES

C1C(SC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CO5

InChI

InChI=1S/C23H20N2O5S/c26-22(24-12-15-7-8-17-19(10-15)30-14-29-17)13-25-16-4-1-2-6-20(16)31-21(11-23(25)27)18-5-3-9-28-18/h1-10,21H,11-14H2,(H,24,26)