2-chloranyl-4,4-dimethyl-3-oxidanylidene-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonyl-3-[(phenylmethyl)sulfonylamino]phenoxy]pentanamide

Systemtic Name: 2-chloranyl-4,4-dimethyl-3-oxidanylidene-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonyl-3-[(phenylmethyl)sulfonylamino]phenoxy]pentanamide Openeye Name: 2-[4-(4-benzyloxyphenyl)sulfonyl-3-(benzylsulfonylamino)phenoxy]-2-chloro-4,4-dimethyl-3-oxo-N-phenyl-pentanamide CAS Name: 2-chloro-4,4-dimethyl-3-oxo-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonyl-3-[(phenylmethyl)sulfonylamino]phenoxy]pentanamide IUPAC Name: 2-[3-(benzylsulfonylamino)-4-(4-phenylmethoxyphenyl)sulfonylphenoxy]-2-chloro-4,4-dimethyl-3-oxo-N-phenylpentanamide Traditional Name: 2-[4-(4-benzoxyphenyl)sulfonyl-3-(benzylsulfonylamino)phenoxy]-2-chloro-3-keto-4,4-dimethyl-N-phenyl-valeramide Formula: C39H37ClN2O8S2 MolecularWeight: 761.30268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(=O)NC1=CC=CC=C1)(OC2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)NS(=O)(=O)CC5=CC=CC=C5)Cl

Isomeric SMILES

CC(C)(C)C(=O)C(C(=O)NC1=CC=CC=C1)(OC2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)NS(=O)(=O)CC5=CC=CC=C5)Cl

InChI

InChI=1S/C39H37ClN2O8S2/c1-38(2,3)36(43)39(40,37(44)41-30-17-11-6-12-18-30)50-32-21-24-35(34(25-32)42-51(45,46)27-29-15-9-5-10-16-29)52(47,48)33-22-19-31(20-23-33)49-26-28-13-7-4-8-14-28/h4-25,42H,26-27H2,1-3H3,(H,41,44)