(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-piperazin-1-yl-propan-1-one

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-piperazin-1-yl-propan-1-one Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-piperazin-1-yl-propan-1-one CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-(1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-piperazin-1-ylpropan-1-one Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-piperazino-propan-1-one Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)SC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)SC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H20N2O3S/c1-11(15(18)17-6-4-16-5-7-17)21-12-2-3-13-14(10-12)20-9-8-19-13/h2-3,10-11,16H,4-9H2,1H3/t11-/m0/s1