methyl 3-[2,4-bis(phenylazanyl)pyrimidin-5-yl]-2-(2-methylphenyl)propanoate

Systemtic Name: methyl 3-[2,4-bis(phenylazanyl)pyrimidin-5-yl]-2-(2-methylphenyl)propanoate Openeye Name: methyl 3-(2,4-dianilinopyrimidin-5-yl)-2-(o-tolyl)propanoate CAS Name: 3-(2,4-dianilino-5-pyrimidinyl)-2-(2-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2,4-dianilinopyrimidin-5-yl)-2-(2-methylphenyl)propanoate Traditional Name: 3-(2,4-dianilinopyrimidin-5-yl)-2-(o-tolyl)propionic acid methyl ester Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC2=CN=C(N=C2NC3=CC=CC=C3)NC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(CC2=CN=C(N=C2NC3=CC=CC=C3)NC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H26N4O2/c1-19-11-9-10-16-23(19)24(26(32)33-2)17-20-18-28-27(30-22-14-7-4-8-15-22)31-25(20)29-21-12-5-3-6-13-21/h3-16,18,24H,17H2,1-2H3,(H2,28,29,30,31)