5-tert-butyl-3-(4-chlorophenyl)-2-methyl-N-octyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-tert-butyl-3-(4-chlorophenyl)-2-methyl-N-octyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-tert-butyl-3-(4-chlorophenyl)-2-methyl-N-octyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-tert-butyl-3-(4-chlorophenyl)-2-methyl-N-octyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-tert-butyl-3-(4-chlorophenyl)-2-methyl-N-octylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [5-tert-butyl-3-(4-chlorophenyl)-2-methyl-pyrazolo[1,5-a]pyrimidin-7-yl]-octyl-amine Formula: C25H35ClN4 MolecularWeight: 427.0252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC(=NC2=C(C(=NN12)C)C3=CC=C(C=C3)Cl)C(C)(C)C

Isomeric SMILES

CCCCCCCCNC1=CC(=NC2=C(C(=NN12)C)C3=CC=C(C=C3)Cl)C(C)(C)C

InChI

InChI=1S/C25H35ClN4/c1-6-7-8-9-10-11-16-27-22-17-21(25(3,4)5)28-24-23(18(2)29-30(22)24)19-12-14-20(26)15-13-19/h12-15,17,27H,6-11,16H2,1-5H3