N-[6-acetamido-2-(2-diethylaminoethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[6-acetamido-2-(2-diethylaminoethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[6-acetamido-2-(2-diethylaminoethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-fluoro-benzamide CAS Name: N-[6-acetamido-2-(2-diethylaminoethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-[6-acetamido-2-(2-diethylaminoethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide Traditional Name: N-[6-acetamido-2-(2-diethylaminoethylthio)-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C19H24FN5O3S MolecularWeight: 421.488963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC)CCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H24FN5O3S/c1-4-25(5-2)10-11-29-19-23-16(21-12(3)26)15(18(28)24-19)22-17(27)13-6-8-14(20)9-7-13/h6-9H,4-5,10-11H2,1-3H3,(H,22,27)(H2,21,23,24,26,28)