[4-methyl-2-(2-phenylhexanoylamino)-6-propan-2-yl-pyrimidin-5-yl] ethanoate

Systemtic Name: [4-methyl-2-(2-phenylhexanoylamino)-6-propan-2-yl-pyrimidin-5-yl] ethanoate Openeye Name: [4-isopropyl-6-methyl-2-(2-phenylhexanoylamino)pyrimidin-5-yl] acetate CAS Name: acetic acid [4-methyl-2-[(1-oxo-2-phenylhexyl)amino]-6-propan-2-yl-5-pyrimidinyl] ester IUPAC Name: [4-methyl-2-(2-phenylhexanoylamino)-6-propan-2-ylpyrimidin-5-yl] acetate Traditional Name: acetic acid [4-isopropyl-6-methyl-2-(2-phenylhexanoylamino)pyrimidin-5-yl] ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3/c1-6-7-13-18(17-11-9-8-10-12-17)21(27)25-22-23-15(4)20(28-16(5)26)19(24-22)14(2)3/h8-12,14,18H,6-7,13H2,1-5H3,(H,23,24,25,27)