(Z)-N-[2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]but-2-enamide

Systemtic Name: (Z)-N-[2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]but-2-enamide Openeye Name: (Z)-N-[2-(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]but-2-enamide CAS Name: (Z)-N-[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-2-butenamide IUPAC Name: (Z)-N-[2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]but-2-enamide Traditional Name: (Z)-N-[2-(6-isopropyl-4-keto-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]but-2-enamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C\C(=O)NC1=CC(=NN1C2=NC(=O)C=C(N2)C(C)C)C3=CC=CS3

InChI

InChI=1S/C18H19N5O2S/c1-4-6-16(24)20-15-9-13(14-7-5-8-26-14)22-23(15)18-19-12(11(2)3)10-17(25)21-18/h4-11H,1-3H3,(H,20,24)(H,19,21,25)/b6-4-