[4,6-dimethyl-2-(1-phenylhexylamino)pyrimidin-5-yl] ethanoate

Systemtic Name: [4,6-dimethyl-2-(1-phenylhexylamino)pyrimidin-5-yl] ethanoate Openeye Name: [4,6-dimethyl-2-(1-phenylhexylamino)pyrimidin-5-yl] acetate CAS Name: acetic acid [4,6-dimethyl-2-(1-phenylhexylamino)-5-pyrimidinyl] ester IUPAC Name: [4,6-dimethyl-2-(1-phenylhexylamino)pyrimidin-5-yl] acetate Traditional Name: acetic acid [4,6-dimethyl-2-(1-phenylhexylamino)pyrimidin-5-yl] ester Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC=C1)NC2=NC(=C(C(=N2)C)OC(=O)C)C

Isomeric SMILES

CCCCCC(C1=CC=CC=C1)NC2=NC(=C(C(=N2)C)OC(=O)C)C

InChI

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