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

Systemtic Name: 1-(4-methoxyphenyl)-6-[(1R)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-(4-methoxyphenyl)-6-[(1R)-1-phenylethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-(4-methoxyphenyl)-6-[(1R)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-(4-methoxyphenyl)-6-[(1R)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-(4-methoxyphenyl)-6-[(1R)-1-phenylethyl]-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:

CC(C1=CC=CC=C1)N2CC3=C(NC2)N(C(=S)NC3=O)C4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2CC3=C(NC2)N(C(=S)NC3=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H22N4O2S/c1-14(15-6-4-3-5-7-15)24-12-18-19(22-13-24)25(21(28)23-20(18)26)16-8-10-17(27-2)11-9-16/h3-11,14,22H,12-13H2,1-2H3,(H,23,26,28)/t14-/m1/s1