methyl 3-[[1-methyl-3-(2-methylphenyl)-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-7-yl]-piperidin-4-yl-amino]propanoate

Systemtic Name: methyl 3-[[1-methyl-3-(2-methylphenyl)-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-7-yl]-piperidin-4-yl-amino]propanoate Openeye Name: methyl 3-[[1-methyl-3-(o-tolyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-7-yl]-(4-piperidyl)amino]propanoate CAS Name: 3-[[1-methyl-3-(2-methylphenyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-7-yl]-(4-piperidinyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[1-methyl-3-(2-methylphenyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-7-yl]-piperidin-4-ylamino]propanoate Traditional Name: 3-[[2-keto-1-methyl-3-(o-tolyl)-4H-pyrimido[4,5-d]pyrimidin-7-yl]-(4-piperidyl)amino]propionic acid methyl ester Formula: C23H30N6O3 MolecularWeight: 438.5227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC3=CN=C(N=C3N(C2=O)C)N(CCC(=O)OC)C4CCNCC4

Isomeric SMILES

CC1=CC=CC=C1N2CC3=CN=C(N=C3N(C2=O)C)N(CCC(=O)OC)C4CCNCC4

InChI

InChI=1S/C23H30N6O3/c1-16-6-4-5-7-19(16)29-15-17-14-25-22(26-21(17)27(2)23(29)31)28(13-10-20(30)32-3)18-8-11-24-12-9-18/h4-7,14,18,24H,8-13,15H2,1-3H3