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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCC(=O)OCC

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)CCC(=O)OCC

InChI

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