tert-butyl 4-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(thiophen-2-ylcarbonylamino)phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(thiophene-2-carbonylamino)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[3-[[oxo(thiophen-2-yl)methyl]amino]anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(thiophene-2-carbonylamino)phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(2-thenoylamino)phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H27N3O4S/c1-22(2,3)29-21(28)25-11-9-15(10-12-25)19(26)23-16-6-4-7-17(14-16)24-20(27)18-8-5-13-30-18/h4-8,13-15H,9-12H2,1-3H3,(H,23,26)(H,24,27)