ethyl 4-[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[5-amino-6-(N-ethyl-3-methylanilino)-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-amino-6-(N-ethyl-3-methylanilino)pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C20H28N6O2 MolecularWeight: 384.47532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H28N6O2/c1-4-26(16-8-6-7-15(3)13-16)19-17(21)18(22-14-23-19)24-9-11-25(12-10-24)20(27)28-5-2/h6-8,13-14H,4-5,9-12,21H2,1-3H3