propan-2-yl 2-chloranyl-5-[3,4-dimethyl-2,6-bis(oxidanylidene)-5-thiocyanato-pyrimidin-1-yl]-4-fluoranyl-benzoate

Systemtic Name: propan-2-yl 2-chloranyl-5-[3,4-dimethyl-2,6-bis(oxidanylidene)-5-thiocyanato-pyrimidin-1-yl]-4-fluoranyl-benzoate Openeye Name: isopropyl 2-chloro-5-(3,4-dimethyl-2,6-dioxo-5-thiocyanato-pyrimidin-1-yl)-4-fluoro-benzoate CAS Name: 2-chloro-5-(3,4-dimethyl-2,6-dioxo-5-thiocyanato-1-pyrimidinyl)-4-fluorobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-5-(3,4-dimethyl-2,6-dioxo-5-thiocyanatopyrimidin-1-yl)-4-fluorobenzoate Traditional Name: 2-chloro-5-(2,6-diketo-3,4-dimethyl-5-thiocyanato-pyrimidin-1-yl)-4-fluoro-benzoic acid isopropyl ester Formula: C17H15ClFN3O4S MolecularWeight: 411.835103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)N1C)C2=C(C=C(C(=C2)C(=O)OC(C)C)Cl)F)SC#N

Isomeric SMILES

CC1=C(C(=O)N(C(=O)N1C)C2=C(C=C(C(=C2)C(=O)OC(C)C)Cl)F)SC#N

InChI

InChI=1S/C17H15ClFN3O4S/c1-8(2)26-16(24)10-5-13(12(19)6-11(10)18)22-15(23)14(27-7-20)9(3)21(4)17(22)25/h5-6,8H,1-4H3