2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]-3-(4-fluorophenyl)-5-methyl-6-oxo-4-pyrimidinolate IUPAC Name: 2-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-5-methyl-6-oxopyrimidin-4-olate Traditional Name: 2-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]-3-(4-fluorophenyl)-6-keto-5-methyl-pyrimidin-4-olate Formula: C20H16ClFN3O3S- MolecularWeight: 432.875743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)F)[O-])C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)F)[O-])C

InChI

InChI=1S/C20H17ClFN3O3S/c1-11-15(21)4-3-5-16(11)23-17(26)10-29-20-24-18(27)12(2)19(28)25(20)14-8-6-13(22)7-9-14/h3-9,28H,10H2,1-2H3,(H,23,26)/p-1