N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylphenyl)sulfanylacetamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-piperonyl-acetamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H19NO3S/c1-12-3-5-15(7-13(12)2)23-10-18(20)19-9-14-4-6-16-17(8-14)22-11-21-16/h3-8H,9-11H2,1-2H3,(H,19,20)