N,N-diethyl-1,3-benzodioxole-5-carbothioamide

Systemtic Name: N,N-diethyl-1,3-benzodioxole-5-carbothioamide Openeye Name: N,N-diethyl-1,3-benzodioxole-5-carbothioamide CAS Name: N,N-diethyl-1,3-benzodioxole-5-carbothioamide IUPAC Name: N,N-diethyl-1,3-benzodioxole-5-carbothioamide Traditional Name: N,N-diethyl-1,3-benzodioxole-5-carbothioamide Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCN(CC)C(=S)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H15NO2S/c1-3-13(4-2)12(16)9-5-6-10-11(7-9)15-8-14-10/h5-7H,3-4,8H2,1-2H3