methyl 6-[(7-phenylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(7-phenylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]hexanoate CAS Name: 6-[[oxo-(7-phenyl-3-pyrazolo[1,5-a]pyrimidinyl)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]hexanoate Traditional Name: 6-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]hexanoic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=C2N=CC=C(N2N=C1)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=C2N=CC=C(N2N=C1)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-27-18(25)10-6-3-7-12-22-20(26)16-14-23-24-17(11-13-21-19(16)24)15-8-4-2-5-9-15/h2,4-5,8-9,11,13-14H,3,6-7,10,12H2,1H3,(H,22,26)