N-(azepan-1-ylcarbothioyl)-2-[2,4-bis(bromanyl)phenoxy]ethanamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-2-[2,4-bis(bromanyl)phenoxy]ethanamide Openeye Name: N-(azepane-1-carbothioyl)-2-(2,4-dibromophenoxy)acetamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-2-(2,4-dibromophenoxy)acetamide IUPAC Name: N-(azepane-1-carbothioyl)-2-(2,4-dibromophenoxy)acetamide Traditional Name: N-(azepane-1-carbothioyl)-2-(2,4-dibromophenoxy)acetamide Formula: C15H18Br2N2O2S MolecularWeight: 450.18862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

C1CCCN(CC1)C(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C15H18Br2N2O2S/c16-11-5-6-13(12(17)9-11)21-10-14(20)18-15(22)19-7-3-1-2-4-8-19/h5-6,9H,1-4,7-8,10H2,(H,18,20,22)