[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(thiophen-2-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(thiophen-2-ylmethylsulfanyl)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-thienylmethylsulfanyl)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(thiophen-2-ylmethylthio)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(thiophen-2-ylmethylsulfanyl)phenyl]methanone Traditional Name: (4-piperonylpiperazino)-[2-(2-thenylthio)phenyl]methanone Formula: C24H24N2O3S2 MolecularWeight: 452.58896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4SCC5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4SCC5=CC=CS5

InChI

InChI=1S/C24H24N2O3S2/c27-24(20-5-1-2-6-23(20)31-16-19-4-3-13-30-19)26-11-9-25(10-12-26)15-18-7-8-21-22(14-18)29-17-28-21/h1-8,13-14H,9-12,15-17H2