1-[4-(1,3-benzodioxol-5-ylmethyl)-2-morpholin-4-ylcarbonyl-piperazin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-2-morpholin-4-ylcarbonyl-piperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-2-(morpholine-4-carbonyl)piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-2-[4-morpholinyl(oxo)methyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-2-(morpholine-4-carbonyl)piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[2-(morpholine-4-carbonyl)-4-piperonyl-piperazino]-2-(2-thienyl)ethanone Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC3=C(C=C2)OCO3)C(=O)N4CCOCC4)C(=O)CC5=CC=CS5

Isomeric SMILES

C1CN(C(CN1CC2=CC3=C(C=C2)OCO3)C(=O)N4CCOCC4)C(=O)CC5=CC=CS5

InChI

InChI=1S/C23H27N3O5S/c27-22(13-18-2-1-11-32-18)26-6-5-24(14-17-3-4-20-21(12-17)31-16-30-20)15-19(26)23(28)25-7-9-29-10-8-25/h1-4,11-12,19H,5-10,13-16H2