1-(6-methyl-1,3-benzodioxol-5-yl)butane-1-thiol

Systemtic Name: 1-(6-methyl-1,3-benzodioxol-5-yl)butane-1-thiol Openeye Name: 1-(6-methyl-1,3-benzodioxol-5-yl)butane-1-thiol CAS Name: 1-(6-methyl-1,3-benzodioxol-5-yl)-1-butanethiol IUPAC Name: 1-(6-methyl-1,3-benzodioxol-5-yl)butane-1-thiol Traditional Name: 1-(6-methyl-1,3-benzodioxol-5-yl)butane-1-thiol Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=C(C=C1C)OCO2)S

Isomeric SMILES

CCCC(C1=CC2=C(C=C1C)OCO2)S

InChI

InChI=1S/C12H16O2S/c1-3-4-12(15)9-6-11-10(5-8(9)2)13-7-14-11/h5-6,12,15H,3-4,7H2,1-2H3