ethyl 4-[2-(1,3-dimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(1,3-dimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(1,3-dimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-6-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(1,3-dimethyl-7-oxo-6-pyrazolo[4,3-d]pyrimidinyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1,3-dimethyl-7-oxopyrazolo[4,3-d]pyrimidin-6-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(7-keto-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-6-yl)acetyl]amino]benzoic acid ethyl ester Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)N(N=C3C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)N(N=C3C)C

InChI

InChI=1S/C18H19N5O4/c1-4-27-18(26)12-5-7-13(8-6-12)20-14(24)9-23-10-19-15-11(2)21-22(3)16(15)17(23)25/h5-8,10H,4,9H2,1-3H3,(H,20,24)