5-ethyl-2-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 5-ethyl-2-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 5-ethyl-2-[2-[[4-(4-fluorophenyl)thiazol-2-yl]amino]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 5-ethyl-2-[[2-[[4-(4-fluorophenyl)-2-thiazolyl]amino]-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 5-ethyl-2-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 5-ethyl-2-[[2-[[4-(4-fluorophenyl)thiazol-2-yl]amino]-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C18H16FN4O2S2- MolecularWeight: 403.473643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H17FN4O2S2/c1-3-13-10(2)20-17(23-16(13)25)27-9-15(24)22-18-21-14(8-26-18)11-4-6-12(19)7-5-11/h4-8H,3,9H2,1-2H3,(H,20,23,25)(H,21,22,24)/p-1