methyl 2-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]-methyl-amino]benzoate

Systemtic Name: methyl 2-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]-methyl-amino]benzoate Openeye Name: methyl 2-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-methyl-amino]benzoate CAS Name: 2-[[5-amino-6-(N-ethylanilino)-4-pyrimidinyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-methylamino]benzoate Traditional Name: 2-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-methyl-amino]benzoic acid methyl ester Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2N)N(C)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2N)N(C)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H23N5O2/c1-4-26(15-10-6-5-7-11-15)20-18(22)19(23-14-24-20)25(2)17-13-9-8-12-16(17)21(27)28-3/h5-14H,4,22H2,1-3H3