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

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-1-(2-methylphenyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-[(4-methoxyphenyl)methyl]-1-(o-tolyl)-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-[(4-methoxyphenyl)methyl]-1-(2-methylphenyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-[(4-methoxyphenyl)methyl]-1-(2-methylphenyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-(o-tolyl)-6-p-anisyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(CN(CN3)CC4=CC=C(C=C4)OC)C(=O)NC2=S

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(CN(CN3)CC4=CC=C(C=C4)OC)C(=O)NC2=S

InChI

InChI=1S/C21H22N4O2S/c1-14-5-3-4-6-18(14)25-19-17(20(26)23-21(25)28)12-24(13-22-19)11-15-7-9-16(27-2)10-8-15/h3-10,22H,11-13H2,1-2H3,(H,23,26,28)