[4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-propylpyrimidin-2-yl)benzoate

Systemtic Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-propylpyrimidin-2-yl)benzoate Openeye Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-propylpyrimidin-2-yl)benzoate CAS Name: 4-(5-propyl-2-pyrimidinyl)benzoic acid [4-(5-propyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-(5-propylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-propylpyrimidin-2-yl)benzoic acid [4-(5-propylpyrimidin-2-yl)phenyl] ester Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCC

Isomeric SMILES

CCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=NC=C(C=N4)CCC

InChI

InChI=1S/C27H26N4O2/c1-3-5-19-15-28-25(29-16-19)21-7-9-23(10-8-21)27(32)33-24-13-11-22(12-14-24)26-30-17-20(6-4-2)18-31-26/h7-18H,3-6H2,1-2H3