5-tert-butyl-2-methyl-3-phenyl-N-undecyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-tert-butyl-2-methyl-3-phenyl-N-undecyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-tert-butyl-2-methyl-3-phenyl-N-undecyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-tert-butyl-2-methyl-3-phenyl-N-undecyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-tert-butyl-2-methyl-3-phenyl-N-undecylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (5-tert-butyl-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-undecyl-amine Formula: C28H42N4 MolecularWeight: 434.65988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC1=CC(=NC2=C(C(=NN12)C)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCNC1=CC(=NC2=C(C(=NN12)C)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C28H42N4/c1-6-7-8-9-10-11-12-13-17-20-29-25-21-24(28(3,4)5)30-27-26(22(2)31-32(25)27)23-18-15-14-16-19-23/h14-16,18-19,21,29H,6-13,17,20H2,1-5H3