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

Systemtic Name: N-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioyl]-3-iodanyl-benzamide Openeye Name: N-[(5-tert-butyl-2-hydroxy-phenyl)carbamothioyl]-3-iodo-benzamide CAS Name: N-[(5-tert-butyl-2-hydroxyanilino)-sulfanylidenemethyl]-3-iodobenzamide IUPAC Name: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]-3-iodobenzamide Traditional Name: N-[(5-tert-butyl-2-hydroxy-phenyl)thiocarbamoyl]-3-iodo-benzamide Formula: C18H19IN2O2S MolecularWeight: 454.32513

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C18H19IN2O2S/c1-18(2,3)12-7-8-15(22)14(10-12)20-17(24)21-16(23)11-5-4-6-13(19)9-11/h4-10,22H,1-3H3,(H2,20,21,23,24)