5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-heptadecyl-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C29H43N3O MolecularWeight: 449.67122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=CC(=O)N2C(=N1)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=CC(=O)N2C(=N1)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C29H43N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26-23-29(33)32-28(30-26)24-27(31-32)25-20-17-16-18-21-25/h16-18,20-21,23-24,31H,2-15,19,22H2,1H3