N-[3,5-bis(chloranyl)phenyl]azepane-1-carbothioamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]azepane-1-carbothioamide Openeye Name: N-(3,5-dichlorophenyl)azepane-1-carbothioamide CAS Name: N-(3,5-dichlorophenyl)-1-azepanecarbothioamide IUPAC Name: N-(3,5-dichlorophenyl)azepane-1-carbothioamide Traditional Name: N-(3,5-dichlorophenyl)azepane-1-carbothioamide Formula: C13H16Cl2N2S MolecularWeight: 303.25054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C13H16Cl2N2S/c14-10-7-11(15)9-12(8-10)16-13(18)17-5-3-1-2-4-6-17/h7-9H,1-6H2,(H,16,18)