[4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] ethanoate

Systemtic Name: [4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] ethanoate Openeye Name: [4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] acetate CAS Name: acetic acid [4,6-dimethyl-2-(2-phenylhexylamino)-5-pyrimidinyl] ester IUPAC Name: [4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] acetate Traditional Name: acetic acid [4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] ester Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=NC(=C(C(=N1)C)OC(=O)C)C)C2=CC=CC=C2

Isomeric SMILES

CCCCC(CNC1=NC(=C(C(=N1)C)OC(=O)C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3O2/c1-5-6-10-18(17-11-8-7-9-12-17)13-21-20-22-14(2)19(15(3)23-20)25-16(4)24/h7-9,11-12,18H,5-6,10,13H2,1-4H3,(H,21,22,23)