3,5,6-trimethyl-2-(3-pyrimidin-2-ylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3,5,6-trimethyl-2-(3-pyrimidin-2-ylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3,5,6-trimethyl-2-(3-pyrimidin-2-ylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3,5,6-trimethyl-2-[3-(2-pyrimidinyl)propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3,5,6-trimethyl-2-(3-pyrimidin-2-ylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3,5,6-trimethyl-2-[3-(2-pyrimidyl)propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC3=NC=CC=N3)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC3=NC=CC=N3)C)C

InChI

InChI=1S/C16H18N4OS2/c1-10-11(2)23-14-13(10)15(21)20(3)16(19-14)22-9-4-6-12-17-7-5-8-18-12/h5,7-8H,4,6,9H2,1-3H3