[4-[(4-cyano-2,2-dimethyl-butyl)-(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid

Systemtic Name: [4-[(4-cyano-2,2-dimethyl-butyl)-(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid Openeye Name: [3-[benzenesulfonyl-(4-cyano-2,2-dimethyl-butyl)amino]-1-benzyl-2-hydroxy-propyl]carbamic acid CAS Name: [4-[benzenesulfonyl-(4-cyano-2,2-dimethylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid IUPAC Name: [4-[benzenesulfonyl-(4-cyano-2,2-dimethylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid Traditional Name: [1-benzyl-3-[besyl-(4-cyano-2,2-dimethyl-butyl)amino]-2-hydroxy-propyl]carbamic acid Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O5S/c1-24(2,14-9-15-25)18-27(33(31,32)20-12-7-4-8-13-20)17-22(28)21(26-23(29)30)16-19-10-5-3-6-11-19/h3-8,10-13,21-22,26,28H,9,14,16-18H2,1-2H3,(H,29,30)