2-[2,4-bis(bromanyl)phenoxy]-N-[(4-phenylazanylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)phenoxy]-N-[(4-phenylazanylphenyl)carbamothioyl]ethanamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-2-(2,4-dibromophenoxy)acetamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-2-(2,4-dibromophenoxy)acetamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-2-(2,4-dibromophenoxy)acetamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-2-(2,4-dibromophenoxy)acetamide Formula: C21H17Br2N3O2S MolecularWeight: 535.25158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=C(C=C(C=C3)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=C(C=C(C=C3)Br)Br

InChI

InChI=1S/C21H17Br2N3O2S/c22-14-6-11-19(18(23)12-14)28-13-20(27)26-21(29)25-17-9-7-16(8-10-17)24-15-4-2-1-3-5-15/h1-12,24H,13H2,(H2,25,26,27,29)