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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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