2-[(1R)-1-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(1R)-1-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1R)-1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1R)-1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1R)-1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1R)-1-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@H](C)C2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H20N4O2S2/c1-3-7-14-10-16(26)23-21(22-14)29-12(2)18-24-19(27)17-15(11-28-20(17)25-18)13-8-5-4-6-9-13/h4-6,8-12H,3,7H2,1-2H3,(H,22,23,26)(H,24,25,27)/t12-/m1/s1