2-[tert-butyl(2-pyrimidin-2-ylsulfanylethanoyl)amino]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[tert-butyl(2-pyrimidin-2-ylsulfanylethanoyl)amino]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[tert-butyl-(2-pyrimidin-2-ylsulfanylacetyl)amino]-N-(4-fluorophenyl)acetamide CAS Name: 2-[tert-butyl-[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[tert-butyl-(2-pyrimidin-2-ylsulfanylacetyl)amino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[tert-butyl-[2-(2-pyrimidylthio)acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C18H21FN4O2S MolecularWeight: 376.448343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC(=O)NC1=CC=C(C=C1)F)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC(C)(C)N(CC(=O)NC1=CC=C(C=C1)F)C(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C18H21FN4O2S/c1-18(2,3)23(16(25)12-26-17-20-9-4-10-21-17)11-15(24)22-14-7-5-13(19)6-8-14/h4-10H,11-12H2,1-3H3,(H,22,24)