tert-butyl 4-[[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]-(4-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]-(4-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[(1S)-1-carbamoyl-3-methyl-butyl]-(4-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-(4-chlorophenyl)sulfonylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-(4-chlorophenyl)sulfonylamino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[(1S)-1-carbamoyl-3-methyl-butyl]-(4-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H36ClN3O5S MolecularWeight: 502.06704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)N(CC1CCN(CC1)C(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)N(CC1CCN(CC1)C(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H36ClN3O5S/c1-16(2)14-20(21(25)28)27(33(30,31)19-8-6-18(24)7-9-19)15-17-10-12-26(13-11-17)22(29)32-23(3,4)5/h6-9,16-17,20H,10-15H2,1-5H3,(H2,25,28)/t20-/m0/s1