propan-2-yl 3-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxoethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C20H23N5O4/c1-13(2)29-18(27)9-16(14-7-5-4-6-8-14)23-17(26)11-25-12-21-19-15(20(25)28)10-22-24(19)3/h4-8,10,12-13,16H,9,11H2,1-3H3,(H,23,26)