N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]ethanethioamide

Systemtic Name: N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]ethanethioamide Openeye Name: N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]thioacetamide CAS Name: N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]ethanethioamide IUPAC Name: N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]ethanethioamide Traditional Name: N-[(3,4-dichlorophenyl)-(1H-imidazol-5-yl)methyl]thioacetamide Formula: C12H11Cl2N3S MolecularWeight: 300.20684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC(C1=CC(=C(C=C1)Cl)Cl)C2=CN=CN2

Isomeric SMILES

CC(=S)NC(C1=CC(=C(C=C1)Cl)Cl)C2=CN=CN2

InChI

InChI=1S/C12H11Cl2N3S/c1-7(18)17-12(11-5-15-6-16-11)8-2-3-9(13)10(14)4-8/h2-6,12H,1H3,(H,15,16)(H,17,18)