(2R)-N-(1,3-benzodioxol-5-yl)-2-(2,5-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(2,5-dimethylphenyl)sulfanyl-propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(2,5-dimethylphenyl)sulfanyl-propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[(2,5-dimethylphenyl)thio]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(2,5-dimethylphenyl)sulfanylpropanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[(2,5-dimethylphenyl)thio]propionamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S[C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19NO3S/c1-11-4-5-12(2)17(8-11)23-13(3)18(20)19-14-6-7-15-16(9-14)22-10-21-15/h4-9,13H,10H2,1-3H3,(H,19,20)/t13-/m1/s1