[4,6-dimethyl-2-(1-phenylpentylamino)pyrimidin-5-yl] benzoate

Systemtic Name: [4,6-dimethyl-2-(1-phenylpentylamino)pyrimidin-5-yl] benzoate Openeye Name: [4,6-dimethyl-2-(1-phenylpentylamino)pyrimidin-5-yl] benzoate CAS Name: benzoic acid [4,6-dimethyl-2-(1-phenylpentylamino)-5-pyrimidinyl] ester IUPAC Name: [4,6-dimethyl-2-(1-phenylpentylamino)pyrimidin-5-yl] benzoate Traditional Name: benzoic acid [4,6-dimethyl-2-(1-phenylpentylamino)pyrimidin-5-yl] ester Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)NC2=NC(=C(C(=N2)C)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC(C1=CC=CC=C1)NC2=NC(=C(C(=N2)C)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C24H27N3O2/c1-4-5-16-21(19-12-8-6-9-13-19)27-24-25-17(2)22(18(3)26-24)29-23(28)20-14-10-7-11-15-20/h6-15,21H,4-5,16H2,1-3H3,(H,25,26,27)