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

Systemtic Name: tert-butyl 4-[4-[[methyl(phenyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(N-methylanilino)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-methyl-2-phenylhydrazinyl)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(N-methylanilino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(N-methylanilino)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NN(C)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NN(C)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-21(2,3)28-20(27)25-12-10-15(11-13-25)19-22-17(14-29-19)18(26)23-24(4)16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3,(H,23,26)