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

Systemtic Name: 1-(4-methoxyphenyl)-6-(phenylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-benzyl-1-(4-methoxyphenyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-(4-methoxyphenyl)-6-(phenylmethyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-benzyl-1-(4-methoxyphenyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-benzyl-1-(4-methoxyphenyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(CN(CN3)CC4=CC=CC=C4)C(=O)NC2=S

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(CN(CN3)CC4=CC=CC=C4)C(=O)NC2=S

InChI

InChI=1S/C20H20N4O2S/c1-26-16-9-7-15(8-10-16)24-18-17(19(25)22-20(24)27)12-23(13-21-18)11-14-5-3-2-4-6-14/h2-10,21H,11-13H2,1H3,(H,22,25,27)