S-[4-[2-(1,3-benzodioxol-5-yl)ethanoyl]-3-oxidanyl-phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[4-[2-(1,3-benzodioxol-5-yl)ethanoyl]-3-oxidanyl-phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[4-[2-(1,3-benzodioxol-5-yl)acetyl]-3-hydroxy-phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[4-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-3-hydroxyphenyl] ester IUPAC Name: S-[4-[2-(1,3-benzodioxol-5-yl)acetyl]-3-hydroxyphenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[4-[2-(1,3-benzodioxol-5-yl)acetyl]-3-hydroxy-phenyl] ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=CC(=C(C=C1)C(=O)CC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CN(C)C(=O)SC1=CC(=C(C=C1)C(=O)CC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C18H17NO5S/c1-19(2)18(22)25-12-4-5-13(15(21)9-12)14(20)7-11-3-6-16-17(8-11)24-10-23-16/h3-6,8-9,21H,7,10H2,1-2H3