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

Systemtic Name: tert-butyl 4-[4-[[methyl-(3-nitropyridin-2-yl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[[methyl-(3-nitro-2-pyridyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[2-methyl-2-(3-nitro-2-pyridinyl)hydrazinyl]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[methyl-(3-nitropyridin-2-yl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[methyl-(3-nitro-2-pyridyl)amino]carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H26N6O5S MolecularWeight: 462.52264

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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=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NN(C)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O5S/c1-20(2,3)31-19(28)25-10-7-13(8-11-25)18-22-14(12-32-18)17(27)23-24(4)16-15(26(29)30)6-5-9-21-16/h5-6,9,12-13H,7-8,10-11H2,1-4H3,(H,23,27)