tert-butyl N-[(2S)-1-[(4-bromophenyl)sulfonylamino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(4-bromophenyl)sulfonylamino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(4-bromophenyl)sulfonylcarbamoyl]butyl]carbamate CAS Name: N-[(2S)-1-[(4-bromophenyl)sulfonylamino]-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(4-bromophenyl)sulfonylamino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-(brosylcarbamoyl)butyl]carbamic acid tert-butyl ester Formula: C16H23BrN2O5S MolecularWeight: 435.33322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NS(=O)(=O)C1=CC=C(C=C1)Br)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC[C@@H](C(=O)NS(=O)(=O)C1=CC=C(C=C1)Br)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H23BrN2O5S/c1-5-6-13(18-15(21)24-16(2,3)4)14(20)19-25(22,23)12-9-7-11(17)8-10-12/h7-10,13H,5-6H2,1-4H3,(H,18,21)(H,19,20)/t13-/m0/s1