N-(6-azanyl-4-oxidanylidene-2-propan-2-ylsulfanyl-1H-pyrimidin-5-yl)-4-fluoranyl-benzamide

Systemtic Name: N-(6-azanyl-4-oxidanylidene-2-propan-2-ylsulfanyl-1H-pyrimidin-5-yl)-4-fluoranyl-benzamide Openeye Name: N-(6-amino-2-isopropylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-fluoro-benzamide CAS Name: N-[6-amino-4-oxo-2-(propan-2-ylthio)-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-(6-amino-4-oxo-2-propan-2-ylsulfanyl-1H-pyrimidin-5-yl)-4-fluorobenzamide Traditional Name: N-[6-amino-2-(isopropylthio)-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C14H15FN4O2S MolecularWeight: 322.357903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H15FN4O2S/c1-7(2)22-14-18-11(16)10(13(21)19-14)17-12(20)8-3-5-9(15)6-4-8/h3-7H,1-2H3,(H,17,20)(H3,16,18,19,21)