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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-(4-piperonyloylpiperazino)-1-(2-thienyl)ethanone Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18N2O4S/c21-14(17-2-1-9-25-17)11-19-5-7-20(8-6-19)18(22)13-3-4-15-16(10-13)24-12-23-15/h1-4,9-10H,5-8,11-12H2