6-ethyl-2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-ethyl-2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-ethyl-2-[[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-ethyl-2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-ethyl-2-[[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C18H21FN4O2S MolecularWeight: 376.448343

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H21FN4O2S/c1-2-14-11-16(24)21-18(20-14)26-12-17(25)23-9-7-22(8-10-23)15-5-3-13(19)4-6-15/h3-6,11H,2,7-10,12H2,1H3,(H,20,21,24)