N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C19H22IN3O3S2 MolecularWeight: 531.43075

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)I

InChI

InChI=1S/C19H22IN3O3S2/c1-12-5-6-13(11-16(12)20)17(24)22-18(27)21-14-7-9-15(10-8-14)28(25,26)23-19(2,3)4/h5-11,23H,1-4H3,(H2,21,22,24,27)