S-[oxidanyl(prop-2-ynyl)amino] 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbothioate

Systemtic Name: S-[oxidanyl(prop-2-ynyl)amino] 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbothioate Openeye Name: S-[hydroxy(prop-2-ynyl)amino] 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbothioate CAS Name: 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]benzenecarbothioic acid S-[hydroxy(prop-2-ynyl)amino] ester IUPAC Name: S-[hydroxy(prop-2-ynyl)amino] 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbothioate Traditional Name: 2-chloro-5-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-4-fluoro-thiobenzoic acid S-[hydroxy(propargyl)amino] ester Formula: C16H10ClF4N3O4S MolecularWeight: 451.779913

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)SN(CC#C)O)Cl)F)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)SN(CC#C)O)Cl)F)C(F)(F)F

InChI

InChI=1S/C16H10ClF4N3O4S/c1-3-4-23(28)29-14(26)8-5-11(10(18)6-9(8)17)24-13(25)7-12(16(19,20)21)22(2)15(24)27/h1,5-7,28H,4H2,2H3