benzene; 1-[(4,5-dimethylpyrimidin-2-yl)amino]pentyl benzoate

Systemtic Name: benzene; 1-[(4,5-dimethylpyrimidin-2-yl)amino]pentyl benzoate Openeye Name: benzene; 1-[(4,5-dimethylpyrimidin-2-yl)amino]pentyl benzoate CAS Name: benzene; benzoic acid 1-[(4,5-dimethyl-2-pyrimidinyl)amino]pentyl ester IUPAC Name: benzene; 1-[(4,5-dimethylpyrimidin-2-yl)amino]pentyl benzoate Traditional Name: benzene; benzoic acid 1-[(4,5-dimethylpyrimidin-2-yl)amino]pentyl ester Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(NC1=NC=C(C(=N1)C)C)OC(=O)C2=CC=CC=C2.C1=CC=CC=C1

Isomeric SMILES

CCCCC(NC1=NC=C(C(=N1)C)C)OC(=O)C2=CC=CC=C2.C1=CC=CC=C1

InChI

InChI=1S/C18H23N3O2.C6H6/c1-4-5-11-16(21-18-19-12-13(2)14(3)20-18)23-17(22)15-9-7-6-8-10-15;1-2-4-6-5-3-1/h6-10,12,16H,4-5,11H2,1-3H3,(H,19,20,21);1-6H