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

Systemtic Name: 2-ethylsulfanyl-N-[2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-pyrazol-3-yl]benzamide Openeye Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-ethylsulfanyl-benzamide CAS Name: 2-(ethylthio)-N-[2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-5-thiophen-2-yl-3-pyrazolyl]benzamide IUPAC Name: N-[2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-2-ethylsulfanylbenzamide Traditional Name: N-[2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-2-(ethylthio)benzamide Formula: C28H25N5O2S2 MolecularWeight: 527.6604

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC2=CC(=NN2C3=NC(=O)C(=C(N3)C)CC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C28H25N5O2S2/c1-3-36-23-13-8-7-12-20(23)26(34)30-25-17-22(24-14-9-15-37-24)32-33(25)28-29-18(2)21(27(35)31-28)16-19-10-5-4-6-11-19/h4-15,17H,3,16H2,1-2H3,(H,30,34)(H,29,31,35)