2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(4-cyanophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(4-cyanophenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-N-[(4-cyanophenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-chlorophenoxy)-N-[(4-cyanoanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-N-[(4-cyanophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-N-[(4-cyanophenyl)thiocarbamoyl]acetamide Formula: C16H11BrClN3O2S MolecularWeight: 424.69944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C16H11BrClN3O2S/c17-11-3-6-14(13(18)7-11)23-9-15(22)21-16(24)20-12-4-1-10(8-19)2-5-12/h1-7H,9H2,(H2,20,21,22,24)