N-[2-(4-methylphenyl)sulfanylethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(p-tolylthio)ethyl]-piperonylamide Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17NO3S/c1-12-2-5-14(6-3-12)22-9-8-18-17(19)13-4-7-15-16(10-13)21-11-20-15/h2-7,10H,8-9,11H2,1H3,(H,18,19)