tert-butyl 4-[4-[(2-fluoranyl-4-methyl-phenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-fluoranyl-4-methyl-phenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-fluoro-4-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-fluoro-4-methylanilino)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-fluoro-4-methylphenyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-fluoro-4-methyl-phenyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OC(C)(C)C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OC(C)(C)C)F

InChI

InChI=1S/C21H26FN3O3S/c1-13-5-6-16(15(22)11-13)23-18(26)17-12-29-19(24-17)14-7-9-25(10-8-14)20(27)28-21(2,3)4/h5-6,11-12,14H,7-10H2,1-4H3,(H,23,26)