methyl (2S)-2-benzamido-3-(2-oxidanylidene-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propanoate

Systemtic Name: methyl (2S)-2-benzamido-3-(2-oxidanylidene-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propanoate Openeye Name: methyl (2S)-2-benzamido-3-(2-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propanoate CAS Name: (2S)-2-benzamido-3-(2-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-benzamido-3-(2-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propanoate Traditional Name: (2S)-2-benzamido-3-(2-keto-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-yl)propionic acid methyl ester Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=NC2=C(C(=O)NN12)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CC1=CC=NC2=C(C(=O)NN12)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O4/c1-31-23(30)18(25-21(28)16-10-6-3-7-11-16)14-17-12-13-24-20-19(22(29)26-27(17)20)15-8-4-2-5-9-15/h2-13,18H,14H2,1H3,(H,25,28)(H,26,29)/t18-/m0/s1