N-(azepan-1-ylcarbothioyl)-2-[2,4-bis(chloranyl)phenoxy]propanamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-2-[2,4-bis(chloranyl)phenoxy]propanamide Openeye Name: N-(azepane-1-carbothioyl)-2-(2,4-dichlorophenoxy)propanamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-2-(2,4-dichlorophenoxy)propanamide IUPAC Name: N-(azepane-1-carbothioyl)-2-(2,4-dichlorophenoxy)propanamide Traditional Name: N-(azepane-1-carbothioyl)-2-(2,4-dichlorophenoxy)propionamide Formula: C16H20Cl2N2O2S MolecularWeight: 375.3132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)N1CCCCCC1)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(=S)N1CCCCCC1)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H20Cl2N2O2S/c1-11(22-14-7-6-12(17)10-13(14)18)15(21)19-16(23)20-8-4-2-3-5-9-20/h6-7,10-11H,2-5,8-9H2,1H3,(H,19,21,23)