N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(2-quinolylthio)acetamide Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H24N2O3S/c1-15(2)23(17-7-9-19-20(13-17)28-12-11-27-19)25-21(26)14-29-22-10-8-16-5-3-4-6-18(16)24-22/h3-10,13,15,23H,11-12,14H2,1-2H3,(H,25,26)/t23-/m1/s1