N-(azepan-1-ylcarbothioyl)-2-(4-bromanylphenoxy)ethanamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-2-(4-bromanylphenoxy)ethanamide Openeye Name: N-(azepane-1-carbothioyl)-2-(4-bromophenoxy)acetamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-2-(4-bromophenoxy)acetamide IUPAC Name: N-(azepane-1-carbothioyl)-2-(4-bromophenoxy)acetamide Traditional Name: N-(azepane-1-carbothioyl)-2-(4-bromophenoxy)acetamide Formula: C15H19BrN2O2S MolecularWeight: 371.29256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19BrN2O2S/c16-12-5-7-13(8-6-12)20-11-14(19)17-15(21)18-9-3-1-2-4-10-18/h5-8H,1-4,9-11H2,(H,17,19,21)