tert-butyl 4-[4-(4-fluorophenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-methylsulfanylpyrimidin-4-yl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-(4-fluorophenyl)-5-[2-(methylthio)-4-pyrimidinyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-fluorophenyl)-5-(2-methylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(4-fluorophenyl)-5-[2-(methylthio)pyrimidin-4-yl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H27FN4O2S2 MolecularWeight: 486.625183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=C(S2)C3=NC(=NC=C3)SC)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=C(S2)C3=NC(=NC=C3)SC)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H27FN4O2S2/c1-24(2,3)31-23(30)29-13-10-16(11-14-29)21-28-19(15-5-7-17(25)8-6-15)20(33-21)18-9-12-26-22(27-18)32-4/h5-9,12,16H,10-11,13-14H2,1-4H3