N-(4-butylphenyl)-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine

Systemtic Name: N-(4-butylphenyl)-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine Openeye Name: N-(4-butylphenyl)-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine CAS Name: N-(4-butylphenyl)-2-(3,5-dimethyl-1-pyrazolyl)-5-ethyl-6-methyl-4-pyrimidinamine IUPAC Name: N-(4-butylphenyl)-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4-amine Traditional Name: (4-butylphenyl)-[2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-yl]amine Formula: C22H29N5 MolecularWeight: 363.49916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2CC)C)N3C(=CC(=N3)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2CC)C)N3C(=CC(=N3)C)C

InChI

InChI=1S/C22H29N5/c1-6-8-9-18-10-12-19(13-11-18)24-21-20(7-2)17(5)23-22(25-21)27-16(4)14-15(3)26-27/h10-14H,6-9H2,1-5H3,(H,23,24,25)