N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C18H17N3O3S2/c1-21(8-12-9-23-14-4-2-3-5-15(14)24-12)16(22)10-26-18-13-6-7-25-17(13)19-11-20-18/h2-7,11-12H,8-10H2,1H3/t12-/m0/s1