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

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

Systemtic Name:[4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] benzoate
Openeye Name:[4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] benzoate
CAS Name:benzoic acid [4,6-dimethyl-2-(2-phenylhexylamino)-5-pyrimidinyl] ester
IUPAC Name:[4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] benzoate
Traditional Name:benzoic acid [4,6-dimethyl-2-(2-phenylhexylamino)pyrimidin-5-yl] ester
Formula: C25H29N3O2
MolecularWeight: 403.51666
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=NC(=C(C(=N1)C)OC(=O)C2=CC=CC=C2)C)C3=CC=CC=C3


Isomeric SMILES

CCCCC(CNC1=NC(=C(C(=N1)C)OC(=O)C2=CC=CC=C2)C)C3=CC=CC=C3


InChI

InChI=1S/C25H29N3O2/c1-4-5-12-22(20-13-8-6-9-14-20)17-26-25-27-18(2)23(19(3)28-25)30-24(29)21-15-10-7-11-16-21/h6-11,13-16,22H,4-5,12,17H2,1-3H3,(H,26,27,28)


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