tert-butyl N-[(2S)-4-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-[2-methylpropyl-(4-nitrophenyl)sulfonyl-amino]-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-3-[isobutyl-(4-nitrophenyl)sulfonyl-amino]-2-oxo-propyl]carbamate CAS Name: N-[(2S)-4-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-3-oxo-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-3-oxo-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-3-[isobutyl(nosyl)amino]-2-keto-propyl]carbamic acid tert-butyl ester Formula: C25H33N3O7S MolecularWeight: 519.61042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C25H33N3O7S/c1-18(2)16-27(36(33,34)21-13-11-20(12-14-21)28(31)32)17-23(29)22(15-19-9-7-6-8-10-19)26-24(30)35-25(3,4)5/h6-14,18,22H,15-17H2,1-5H3,(H,26,30)/t22-/m0/s1