2-iodanyl-N-[2-(4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]benzamide

Systemtic Name: 2-iodanyl-N-[2-(4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]benzamide Openeye Name: 2-iodo-N-[2-(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]benzamide CAS Name: 2-iodo-N-[2-(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]benzamide IUPAC Name: 2-iodo-N-[2-(4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]benzamide Traditional Name: 2-iodo-N-[2-(4-keto-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]benzamide Formula: C21H16IN5O2S MolecularWeight: 529.35351

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)NC(=NC2=O)N3C(=CC(=N3)C4=CC=CS4)NC(=O)C5=CC=CC=C5I

Isomeric SMILES

C1CC2=C(C1)NC(=NC2=O)N3C(=CC(=N3)C4=CC=CS4)NC(=O)C5=CC=CC=C5I

InChI

InChI=1S/C21H16IN5O2S/c22-14-7-2-1-5-12(14)19(28)24-18-11-16(17-9-4-10-30-17)26-27(18)21-23-15-8-3-6-13(15)20(29)25-21/h1-2,4-5,7,9-11H,3,6,8H2,(H,24,28)(H,23,25,29)