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

Systemtic Name: N-(6-azanyl-2-cyclopentylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-fluoranyl-benzamide Openeye Name: N-(6-amino-2-cyclopentylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-fluoro-benzamide CAS Name: N-[6-amino-2-(cyclopentylthio)-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-(6-amino-2-cyclopentylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-fluorobenzamide Traditional Name: N-[6-amino-2-(cyclopentylthio)-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C16H17FN4O2S MolecularWeight: 348.395183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(C1)SC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4O2S/c17-10-7-5-9(6-8-10)14(22)19-12-13(18)20-16(21-15(12)23)24-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,19,22)(H3,18,20,21,23)