4-tert-butyl-N-[(5-tert-butyl-3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(5-tert-butyl-3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(5-tert-butyl-3-chloro-2-hydroxy-phenyl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[(5-tert-butyl-3-chloro-2-hydroxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(5-tert-butyl-3-chloro-2-hydroxyphenyl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(5-tert-butyl-3-chloro-2-hydroxy-phenyl)thiocarbamoyl]benzamide Formula: C22H27ClN2O2S MolecularWeight: 418.97998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=CC(=C2)C(C)(C)C)Cl)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=CC(=C2)C(C)(C)C)Cl)O

InChI

InChI=1S/C22H27ClN2O2S/c1-21(2,3)14-9-7-13(8-10-14)19(27)25-20(28)24-17-12-15(22(4,5)6)11-16(23)18(17)26/h7-12,26H,1-6H3,(H2,24,25,27,28)