methyl 4-[[2-(4-ethoxyphenyl)-5-piperidin-4-yl-pyrazolo[1,5-a]pyrimidin-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(4-ethoxyphenyl)-5-piperidin-4-yl-pyrazolo[1,5-a]pyrimidin-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(4-ethoxyphenyl)-5-(4-piperidyl)pyrazolo[1,5-a]pyrimidine-6-carbonyl]amino]benzoate CAS Name: 4-[[[2-(4-ethoxyphenyl)-5-(4-piperidinyl)-6-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-ethoxyphenyl)-5-piperidin-4-ylpyrazolo[1,5-a]pyrimidine-6-carbonyl]amino]benzoate Traditional Name: 4-[[5-(4-piperidyl)-2-p-phenetyl-pyrazolo[1,5-a]pyrimidine-6-carbonyl]amino]benzoic acid methyl ester Formula: C28H29N5O4 MolecularWeight: 499.56096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN3C=C(C(=NC3=C2)C4CCNCC4)C(=O)NC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN3C=C(C(=NC3=C2)C4CCNCC4)C(=O)NC5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C28H29N5O4/c1-3-37-22-10-6-18(7-11-22)24-16-25-31-26(19-12-14-29-15-13-19)23(17-33(25)32-24)27(34)30-21-8-4-20(5-9-21)28(35)36-2/h4-11,16-17,19,29H,3,12-15H2,1-2H3,(H,30,34)