1-(1,3-benzodioxol-5-yl)butane-2-thiol

Systemtic Name: 1-(1,3-benzodioxol-5-yl)butane-2-thiol Openeye Name: 1-(1,3-benzodioxol-5-yl)butane-2-thiol CAS Name: 1-(1,3-benzodioxol-5-yl)-2-butanethiol IUPAC Name: 1-(1,3-benzodioxol-5-yl)butane-2-thiol Traditional Name: 1-(1,3-benzodioxol-5-yl)butane-2-thiol Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC2=C(C=C1)OCO2)S

Isomeric SMILES

CCC(CC1=CC2=C(C=C1)OCO2)S

InChI

InChI=1S/C11H14O2S/c1-2-9(14)5-8-3-4-10-11(6-8)13-7-12-10/h3-4,6,9,14H,2,5,7H2,1H3