2-[[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]-N-propyl-ethanamide

Systemtic Name: 2-[[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]-N-propyl-ethanamide Openeye Name: 2-[[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]-N-propyl-acetamide CAS Name: 2-[[5,6-dimethyl-2-[(phenylthio)methyl]-4-thieno[2,3-d]pyrimidinyl]-methylamino]-N-propylacetamide IUPAC Name: 2-[[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]-methylamino]-N-propylacetamide Traditional Name: 2-[[5,6-dimethyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]-N-propyl-acetamide Formula: C21H26N4OS2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C1=C2C(=C(SC2=NC(=N1)CSC3=CC=CC=C3)C)C

Isomeric SMILES

CCCNC(=O)CN(C)C1=C2C(=C(SC2=NC(=N1)CSC3=CC=CC=C3)C)C

InChI

InChI=1S/C21H26N4OS2/c1-5-11-22-18(26)12-25(4)20-19-14(2)15(3)28-21(19)24-17(23-20)13-27-16-9-7-6-8-10-16/h6-10H,5,11-13H2,1-4H3,(H,22,26)