tert-butyl N-[4-[(4-cyano-2-methyl-butyl)-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[(4-cyano-2-methyl-butyl)-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-3-[(4-cyano-2-methyl-butyl)-(p-tolylsulfonyl)amino]-2-hydroxy-propyl]carbamate CAS Name: N-[4-[(4-cyano-2-methylbutyl)-(4-methylphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(4-cyano-2-methylbutyl)-(4-methylphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[1-benzyl-3-[(4-cyano-2-methyl-butyl)-tosyl-amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C28H39N3O5S MolecularWeight: 529.69136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)CCC#N)CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)CCC#N)CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C28H39N3O5S/c1-21-13-15-24(16-14-21)37(34,35)31(19-22(2)10-9-17-29)20-26(32)25(18-23-11-7-6-8-12-23)30-27(33)36-28(3,4)5/h6-8,11-16,22,25-26,32H,9-10,18-20H2,1-5H3,(H,30,33)