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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(oxolan-2-ylmethylsulfanyl)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(tetrahydrofuran-2-ylmethylsulfanyl)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(2-oxolanylmethylthio)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(oxolan-2-ylmethylsulfanyl)phenyl]methanone Traditional Name: (4-piperonylpiperazino)-[2-(tetrahydrofurfurylthio)phenyl]methanone Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(OC1)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H28N2O4S/c27-24(20-5-1-2-6-23(20)31-16-19-4-3-13-28-19)26-11-9-25(10-12-26)15-18-7-8-21-22(14-18)30-17-29-21/h1-2,5-8,14,19H,3-4,9-13,15-17H2