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

Systemtic Name: (Z)-N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]but-2-enamide Openeye Name: (Z)-N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]but-2-enamide CAS Name: (Z)-N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]-2-butenamide IUPAC Name: (Z)-N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]but-2-enamide Traditional Name: (Z)-N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]but-2-enamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C/C=C\C(=O)NC1=CC(=NN1C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H21N5O2S/c1-3-8-21(29)25-20-14-18(19-11-7-12-31-19)27-28(20)23-24-15(2)17(22(30)26-23)13-16-9-5-4-6-10-16/h3-12,14H,13H2,1-2H3,(H,25,29)(H,24,26,30)/b8-3-