methyl (2S)-2-[(1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(1,3-dimethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1,3-dimethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC(CC4=CC=CC=C4)C(=O)OC)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)OC)C

InChI

InChI=1S/C25H24N4O3/c1-16-22-19(15-20(18-12-8-5-9-13-18)26-23(22)29(2)28-16)24(30)27-21(25(31)32-3)14-17-10-6-4-7-11-17/h4-13,15,21H,14H2,1-3H3,(H,27,30)/t21-/m0/s1