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

Systemtic Name: tert-butyl N-[4-(3-aminophenyl)sulfonyl-2-[(4-cyano-2,2-dimethyl-butyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[3-(3-aminophenyl)sulfonyl-1-benzyl-1-[(4-cyano-2,2-dimethyl-butyl)amino]-2-hydroxy-propyl]carbamate CAS Name: N-[4-(3-aminophenyl)sulfonyl-2-[(4-cyano-2,2-dimethylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(3-aminophenyl)sulfonyl-2-[(4-cyano-2,2-dimethylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[3-(3-aminophenyl)sulfonyl-1-benzyl-1-[(4-cyano-2,2-dimethyl-butyl)amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C28H40N4O5S MolecularWeight: 544.706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)(C(CS(=O)(=O)C2=CC=CC(=C2)N)O)NCC(C)(C)CCC#N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)(C(CS(=O)(=O)C2=CC=CC(=C2)N)O)NCC(C)(C)CCC#N

InChI

InChI=1S/C28H40N4O5S/c1-26(2,3)37-25(34)32-28(18-21-11-7-6-8-12-21,31-20-27(4,5)15-10-16-29)24(33)19-38(35,36)23-14-9-13-22(30)17-23/h6-9,11-14,17,24,31,33H,10,15,18-20,30H2,1-5H3,(H,32,34)