ethyl 4-oxidanylidene-4-[[2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]amino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[[2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]amino]butanoate Openeye Name: ethyl 4-[[2-(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]amino]butanoate Traditional Name: 4-[[2-(6-isopropyl-4-keto-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]amino]-4-keto-butyric acid ethyl ester Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=O)C=C(N2)C(C)C)C3=CC=CS3

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=O)C=C(N2)C(C)C)C3=CC=CS3

InChI

InChI=1S/C20H23N5O4S/c1-4-29-19(28)8-7-17(26)22-16-10-14(15-6-5-9-30-15)24-25(16)20-21-13(12(2)3)11-18(27)23-20/h5-6,9-12H,4,7-8H2,1-3H3,(H,22,26)(H,21,23,27)