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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC3=C(C=C2)OCO3)C

InChI

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