N-(1,3-benzodioxol-5-ylmethyl)-3,4-dimethoxy-benzenecarbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3,4-dimethoxy-benzenecarbothioamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3,4-dimethoxy-benzenecarbothioamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3,4-dimethoxybenzenecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3,4-dimethoxybenzenecarbothioamide Traditional Name: 3,4-dimethoxy-N-piperonyl-thiobenzamide Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=S)NCC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=S)NCC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C17H17NO4S/c1-19-13-6-4-12(8-15(13)20-2)17(23)18-9-11-3-5-14-16(7-11)22-10-21-14/h3-8H,9-10H2,1-2H3,(H,18,23)