N-[4-[(4-cyano-2,2-dimethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-4-methylsulfonyl-butanamide

Systemtic Name: N-[4-[(4-cyano-2,2-dimethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-4-methylsulfonyl-butanamide Openeye Name: N-[1-benzyl-3-[(4-cyano-2,2-dimethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-2-hydroxy-propyl]-3-methyl-4-methylsulfonyl-butanamide CAS Name: N-[4-[(4-cyano-2,2-dimethylbutyl)-(4-methoxyphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]-3-methyl-4-methylsulfonylbutanamide IUPAC Name: N-[4-[(4-cyano-2,2-dimethylbutyl)-(4-methoxyphenyl)sulfonylamino]-3-hydroxy-1-phenylbutan-2-yl]-3-methyl-4-methylsulfonylbutanamide Traditional Name: N-[1-benzyl-3-[(4-cyano-2,2-dimethyl-butyl)-(4-methoxyphenyl)sulfonyl-amino]-2-hydroxy-propyl]-4-mesyl-3-methyl-butyramide Formula: C30H43N3O7S2 MolecularWeight: 621.80832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H43N3O7S2/c1-23(21-41(5,36)37)18-29(35)32-27(19-24-10-7-6-8-11-24)28(34)20-33(22-30(2,3)16-9-17-31)42(38,39)26-14-12-25(40-4)13-15-26/h6-8,10-15,23,27-28,34H,9,16,18-22H2,1-5H3,(H,32,35)