2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-benzylsulfanylethyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(2-benzylsulfanylethyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-[2-(benzylthio)ethyl]acetamide Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCSCC1=CC=CC=C1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCSCC1=CC=CC=C1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O5S2/c1-28(23,24)21(16-7-8-17-18(11-16)26-14-25-17)12-19(22)20-9-10-27-13-15-5-3-2-4-6-15/h2-8,11H,9-10,12-14H2,1H3,(H,20,22)