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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-piperonyl-3-(p-tolylthio)propionamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3S/c1-13-2-5-15(6-3-13)23-9-8-18(20)19-11-14-4-7-16-17(10-14)22-12-21-16/h2-7,10H,8-9,11-12H2,1H3,(H,19,20)