1-[(6-ethylsulfanyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine

Systemtic Name: 1-[(6-ethylsulfanyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine Openeye Name: 1-[(6-ethylsulfanyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine CAS Name: 1-[[6-(ethylthio)-1,3-benzodioxol-5-yl]sulfonyl]piperazine IUPAC Name: 1-[(6-ethylsulfanyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine Traditional Name: 1-[[6-(ethylthio)-1,3-benzodioxol-5-yl]sulfonyl]piperazine Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C2C(=C1)OCO2)S(=O)(=O)N3CCNCC3

Isomeric SMILES

CCSC1=C(C=C2C(=C1)OCO2)S(=O)(=O)N3CCNCC3

InChI

InChI=1S/C13H18N2O4S2/c1-2-20-12-7-10-11(19-9-18-10)8-13(12)21(16,17)15-5-3-14-4-6-15/h7-8,14H,2-6,9H2,1H3