6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-cyclohexyl-1-[2-(2-methoxyphenyl)ethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCN2C3=C(CN(CN3)C4CCCCC4)C(=O)NC2=S

Isomeric SMILES

COC1=CC=CC=C1CCN2C3=C(CN(CN3)C4CCCCC4)C(=O)NC2=S

InChI

InChI=1S/C21H28N4O2S/c1-27-18-10-6-5-7-15(18)11-12-25-19-17(20(26)23-21(25)28)13-24(14-22-19)16-8-3-2-4-9-16/h5-7,10,16,22H,2-4,8-9,11-14H2,1H3,(H,23,26,28)