5-tert-butyl-N-(2-chloranyl-4-nitro-phenyl)-2-methyl-6-oxidanyl-3-phenylsulfanyl-benzamide

Systemtic Name: 5-tert-butyl-N-(2-chloranyl-4-nitro-phenyl)-2-methyl-6-oxidanyl-3-phenylsulfanyl-benzamide Openeye Name: 3-tert-butyl-N-(2-chloro-4-nitro-phenyl)-2-hydroxy-6-methyl-5-phenylsulfanyl-benzamide CAS Name: 3-tert-butyl-N-(2-chloro-4-nitrophenyl)-2-hydroxy-6-methyl-5-(phenylthio)benzamide IUPAC Name: 3-tert-butyl-N-(2-chloro-4-nitrophenyl)-2-hydroxy-6-methyl-5-phenylsulfanylbenzamide Traditional Name: 3-tert-butyl-N-(2-chloro-4-nitro-phenyl)-2-hydroxy-6-methyl-5-(phenylthio)benzamide Formula: C24H23ClN2O4S MolecularWeight: 470.96842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)C(C)(C)C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)C(C)(C)C)SC3=CC=CC=C3

InChI

InChI=1S/C24H23ClN2O4S/c1-14-20(32-16-8-6-5-7-9-16)13-17(24(2,3)4)22(28)21(14)23(29)26-19-11-10-15(27(30)31)12-18(19)25/h5-13,28H,1-4H3,(H,26,29)