tert-butyl 4-[4-[[(2-oxidanylidenepiperidin-3-yl)carbonylamino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[[(2-oxidanylidenepiperidin-3-yl)carbonylamino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[[(2-oxopiperidine-3-carbonyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-[[oxo-(2-oxo-3-piperidinyl)methyl]hydrazo]methyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[(2-oxopiperidine-3-carbonyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[(2-ketonipecotoyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H29N5O5S MolecularWeight: 451.53976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3CCCNC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3CCCNC3=O

InChI

InChI=1S/C20H29N5O5S/c1-20(2,3)30-19(29)25-9-6-12(7-10-25)18-22-14(11-31-18)17(28)24-23-16(27)13-5-4-8-21-15(13)26/h11-13H,4-10H2,1-3H3,(H,21,26)(H,23,27)(H,24,28)