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

Systemtic Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-2-(2-pyrimidylthio)acetamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C18H21N3O3S/c1-12(2)17(13-4-5-14-15(10-13)24-9-8-23-14)21-16(22)11-25-18-19-6-3-7-20-18/h3-7,10,12,17H,8-9,11H2,1-2H3,(H,21,22)/t17-/m1/s1