5,6-dimethyl-2-(3-pyrimidin-2-ylsulfanylpropyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(3-pyrimidin-2-ylsulfanylpropyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(3-pyrimidin-2-ylsulfanylpropyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[3-(2-pyrimidinylthio)propyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(3-pyrimidin-2-ylsulfanylpropyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[3-(2-pyrimidylthio)propyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C15H16N4OS2 MolecularWeight: 332.44374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CCCSC3=NC=CC=N3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CCCSC3=NC=CC=N3)C

InChI

InChI=1S/C15H16N4OS2/c1-9-10(2)22-14-12(9)13(20)18-11(19-14)5-3-8-21-15-16-6-4-7-17-15/h4,6-7H,3,5,8H2,1-2H3,(H,18,19,20)