3-(3,4-dimethylphenyl)sulfanyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)C

InChI

InChI=1S/C20H21NO4S/c1-12-4-5-15(8-13(12)2)26-7-6-20(23)21-17-10-19-18(24-11-25-19)9-16(17)14(3)22/h4-5,8-10H,6-7,11H2,1-3H3,(H,21,23)