N-[(4,5-dimethyl-7-oxidanylidene-3-propyl-pyrazolo[1,5-a]pyrimidin-2-yl)methyl]-3-fluoranyl-N-propyl-benzamide

Systemtic Name: N-[(4,5-dimethyl-7-oxidanylidene-3-propyl-pyrazolo[1,5-a]pyrimidin-2-yl)methyl]-3-fluoranyl-N-propyl-benzamide Openeye Name: N-[(4,5-dimethyl-7-oxo-3-propyl-pyrazolo[1,5-a]pyrimidin-2-yl)methyl]-3-fluoro-N-propyl-benzamide CAS Name: N-[(4,5-dimethyl-7-oxo-3-propyl-2-pyrazolo[1,5-a]pyrimidinyl)methyl]-3-fluoro-N-propylbenzamide IUPAC Name: N-[(4,5-dimethyl-7-oxo-3-propylpyrazolo[1,5-a]pyrimidin-2-yl)methyl]-3-fluoro-N-propylbenzamide Traditional Name: 3-fluoro-N-[(7-keto-4,5-dimethyl-3-propyl-pyrazolo[1,5-a]pyrimidin-2-yl)methyl]-N-propyl-benzamide Formula: C22H27FN4O2 MolecularWeight: 398.473783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2N(C(=CC(=O)N2N=C1CN(CCC)C(=O)C3=CC(=CC=C3)F)C)C

Isomeric SMILES

CCCC1=C2N(C(=CC(=O)N2N=C1CN(CCC)C(=O)C3=CC(=CC=C3)F)C)C

InChI

InChI=1S/C22H27FN4O2/c1-5-8-18-19(24-27-20(28)12-15(3)25(4)21(18)27)14-26(11-6-2)22(29)16-9-7-10-17(23)13-16/h7,9-10,12-13H,5-6,8,11,14H2,1-4H3