tert-butyl N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]carbamate

Systemtic Name: tert-butyl N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]carbamate Openeye Name: tert-butyl N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]carbamate CAS Name: N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-1-oxobutyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methylbutanoyl]amino]carbamate Traditional Name: N-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-butanoyl]amino]carbamic acid tert-butyl ester Formula: C16H24ClN3O5S MolecularWeight: 405.89686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H24ClN3O5S/c1-10(2)13(14(21)18-19-15(22)25-16(3,4)5)20-26(23,24)12-8-6-11(17)7-9-12/h6-10,13,20H,1-5H3,(H,18,21)(H,19,22)/t13-/m0/s1