(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxylate

Systemtic Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxylate Openeye Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxylate CAS Name: 1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxylic acid (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl 1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxylate Traditional Name: 6-keto-1-(p-tolyl)-2-(2-thienyl)nipecotic acid (3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OCC3=NC(=NO3)C(C)(C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OCC3=NC(=NO3)C(C)(C)C)C4=CC=CS4

InChI

InChI=1S/C24H27N3O4S/c1-15-7-9-16(10-8-15)27-20(28)12-11-17(21(27)18-6-5-13-32-18)22(29)30-14-19-25-23(26-31-19)24(2,3)4/h5-10,13,17,21H,11-12,14H2,1-4H3