3-(1,3-benzodioxol-5-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-thienylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(thiophen-2-ylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-thenyl)piperazino]propan-1-one Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N2O3S/c22-19(6-4-15-3-5-17-18(12-15)24-14-23-17)21-9-7-20(8-10-21)13-16-2-1-11-25-16/h1-3,5,11-12H,4,6-10,13-14H2