(2-phenylazanyl-1,3-thiazol-4-yl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2-anilinothiazol-4-yl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid (2-anilinothiazol-4-yl)methyl ester Formula: C23H22FN3O3S MolecularWeight: 439.502483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CSC(=N2)NC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CSC(=N2)NC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN3O3S/c24-18-8-6-16(7-9-18)21(28)27-12-10-17(11-13-27)22(29)30-14-20-15-31-23(26-20)25-19-4-2-1-3-5-19/h1-9,15,17H,10-14H2,(H,25,26)