5-heptadecyl-2-(4-methylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-heptadecyl-2-(4-methylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-heptadecyl-2-(p-tolyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 5-heptadecyl-2-(4-methylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-heptadecyl-2-(4-methylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-heptadecyl-2-(p-tolyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C30H45N3O MolecularWeight: 463.6978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H45N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27-23-30(34)33-29(31-27)24-28(32-33)26-21-19-25(2)20-22-26/h19-24,32H,3-18H2,1-2H3