2-(4-bromanylphenoxy)-N-[4-(ethanoylcarbamothioylamino)phenyl]-2-methyl-propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[4-(ethanoylcarbamothioylamino)phenyl]-2-methyl-propanamide Openeye Name: N-[4-(acetylcarbamothioylamino)phenyl]-2-(4-bromophenoxy)-2-methyl-propanamide CAS Name: N-[4-[[acetamido(sulfanylidene)methyl]amino]phenyl]-2-(4-bromophenoxy)-2-methylpropanamide IUPAC Name: N-[4-(acetylcarbamothioylamino)phenyl]-2-(4-bromophenoxy)-2-methylpropanamide Traditional Name: N-[4-(acetylthiocarbamoylamino)phenyl]-2-(4-bromophenoxy)-2-methyl-propionamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H20BrN3O3S/c1-12(24)21-18(27)23-15-8-6-14(7-9-15)22-17(25)19(2,3)26-16-10-4-13(20)5-11-16/h4-11H,1-3H3,(H,22,25)(H2,21,23,24,27)