N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]acetamide CAS Name: N-[2-[[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]thio]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: N-[2-[[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]thio]-4-hydroxy-6-keto-1H-pyrimidin-5-yl]acetamide Formula: C18H20FN5O4S MolecularWeight: 421.445903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(N=C(NC1=O)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)O

Isomeric SMILES

CC(=O)NC1=C(N=C(NC1=O)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C18H20FN5O4S/c1-11(25)20-15-16(27)21-18(22-17(15)28)29-10-14(26)24-8-6-23(7-9-24)13-4-2-12(19)3-5-13/h2-5H,6-10H2,1H3,(H,20,25)(H2,21,22,27,28)