N-(4-fluorophenyl)-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)benzamide

Systemtic Name: N-(4-fluorophenyl)-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)benzamide Openeye Name: N-(4-fluorophenyl)-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide CAS Name: N-(4-fluorophenyl)-2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]benzamide IUPAC Name: N-(4-fluorophenyl)-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide Traditional Name: N-(4-fluorophenyl)-2-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]benzamide Formula: C21H15FN4O2S2 MolecularWeight: 438.497803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)F)NC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)F)NC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C21H15FN4O2S2/c22-13-5-7-14(8-6-13)25-19(28)15-3-1-2-4-17(15)26-18(27)11-30-21-16-9-10-29-20(16)23-12-24-21/h1-10,12H,11H2,(H,25,28)(H,26,27)