(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=NOC(=C2)C3=CC=CS3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=NOC(=C2)C3=CC=CS3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O4S/c25-20(27-14-17-13-18(28-23-17)19-7-4-12-29-19)15-8-10-24(11-9-15)21(26)22-16-5-2-1-3-6-16/h1-7,12-13,15H,8-11,14H2,(H,22,26)