2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)propanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)propanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)propanamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[3-(methylthio)phenyl]propanamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)propanamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]-N-[3-(methylthio)phenyl]propionamide Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)SC)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)SC)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O5S2/c1-13(19(22)20-14-5-4-6-16(11-14)27-2)21(28(3,23)24)15-7-8-17-18(12-15)26-10-9-25-17/h4-8,11-13H,9-10H2,1-3H3,(H,20,22)