N-[[4-(phenylmethyl)morpholin-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[[4-(phenylmethyl)morpholin-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-[(4-benzylmorpholin-2-yl)methyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[[4-(phenylmethyl)-2-morpholinyl]methyl]-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-[(4-benzylmorpholin-2-yl)methyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-[(4-benzylmorpholin-2-yl)methyl]-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1CC2=CC=CC=C2)CNC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1COC(CN1CC2=CC=CC=C2)CNC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C20H22N4O2S2/c25-18(13-28-20-17-6-9-27-19(17)22-14-23-20)21-10-16-12-24(7-8-26-16)11-15-4-2-1-3-5-15/h1-6,9,14,16H,7-8,10-13H2,(H,21,25)