N-[(2,4-dichlorophenyl)methyl]-4-ethanoyl-1,4-diazepane-1-carbothioamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-4-ethanoyl-1,4-diazepane-1-carbothioamide Openeye Name: 4-acetyl-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carbothioamide CAS Name: 4-acetyl-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carbothioamide IUPAC Name: 4-acetyl-N-[(2,4-dichlorophenyl)methyl]-1,4-diazepane-1-carbothioamide Traditional Name: 4-acetyl-N-(2,4-dichlorobenzyl)-1,4-diazepane-1-carbothioamide Formula: C15H19Cl2N3OS MolecularWeight: 360.30186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=S)NCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=S)NCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H19Cl2N3OS/c1-11(21)19-5-2-6-20(8-7-19)15(22)18-10-12-3-4-13(16)9-14(12)17/h3-4,9H,2,5-8,10H2,1H3,(H,18,22)