methyl 4-[[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]amino]-4-keto-butyric acid methyl ester Formula: C19H24N4O6 MolecularWeight: 404.41706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)CCC(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)CCC(=O)OC

InChI

InChI=1S/C19H24N4O6/c1-26-13-8-11(9-14(27-2)17(13)29-4)7-12-10-21-19(23-18(12)20)22-15(24)5-6-16(25)28-3/h8-10H,5-7H2,1-4H3,(H3,20,21,22,23,24)