N-(1,3-benzodioxol-5-ylmethyl)-2-ethoxy-benzenecarbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethoxy-benzenecarbothioamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethoxy-benzenecarbothioamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethoxybenzenecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethoxybenzenecarbothioamide Traditional Name: 2-ethoxy-N-piperonyl-thiobenzamide Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC1=CC=CC=C1C(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17NO3S/c1-2-19-14-6-4-3-5-13(14)17(22)18-10-12-7-8-15-16(9-12)21-11-20-15/h3-9H,2,10-11H2,1H3,(H,18,22)