N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(p-tolylsulfanyl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(p-tolylthio)propionamide Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO3S/c1-11-3-6-14(7-4-11)22-12(2)17(19)18-13-5-8-15-16(9-13)21-10-20-15/h3-9,12H,10H2,1-2H3,(H,18,19)