6-(2,6-dimethylphenyl)-2-(4-methylpiperidin-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 6-(2,6-dimethylphenyl)-2-(4-methylpiperidin-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-(2,6-dimethylphenyl)-2-(4-methyl-1-piperidyl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-(2,6-dimethylphenyl)-2-(4-methyl-1-piperidinyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-(2,6-dimethylphenyl)-2-(4-methylpiperidin-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-(2,6-dimethylphenyl)-2-(4-methylpiperidino)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=O)C3=C(N2)N=CN(C3=S)C4=C(C=CC=C4C)C

Isomeric SMILES

CC1CCN(CC1)C2=NC(=O)C3=C(N2)N=CN(C3=S)C4=C(C=CC=C4C)C

InChI

InChI=1S/C20H23N5OS/c1-12-7-9-24(10-8-12)20-22-17-15(18(26)23-20)19(27)25(11-21-17)16-13(2)5-4-6-14(16)3/h4-6,11-12H,7-10H2,1-3H3,(H,22,23,26)