N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(2-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(2-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(o-tolylsulfanyl)acetamide CAS Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-[(2-methylphenyl)thio]acetamide IUPAC Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-(2-methylphenyl)sulfanylacetamide Traditional Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(o-tolylthio)acetamide Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC(C2=CC3=C(C=C2)OCCO3)C(C)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N[C@H](C2=CC3=C(C=C2)OCCO3)C(C)C

InChI

InChI=1S/C21H25NO3S/c1-14(2)21(16-8-9-17-18(12-16)25-11-10-24-17)22-20(23)13-26-19-7-5-4-6-15(19)3/h4-9,12,14,21H,10-11,13H2,1-3H3,(H,22,23)/t21-/m0/s1