2-[3-[(4-chlorophenyl)methyl]-5-nitro-imidazol-4-yl]sulfanylethanamide

Systemtic Name: 2-[3-[(4-chlorophenyl)methyl]-5-nitro-imidazol-4-yl]sulfanylethanamide Openeye Name: 2-[3-[(4-chlorophenyl)methyl]-5-nitro-imidazol-4-yl]sulfanylacetamide CAS Name: 2-[[3-[(4-chlorophenyl)methyl]-5-nitro-4-imidazolyl]thio]acetamide IUPAC Name: 2-[3-[(4-chlorophenyl)methyl]-5-nitroimidazol-4-yl]sulfanylacetamide Traditional Name: 2-[[3-(4-chlorobenzyl)-5-nitro-imidazol-4-yl]thio]acetamide Formula: C12H11ClN4O3S MolecularWeight: 326.75874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC(=C2SCC(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC(=C2SCC(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H11ClN4O3S/c13-9-3-1-8(2-4-9)5-16-7-15-11(17(19)20)12(16)21-6-10(14)18/h1-4,7H,5-6H2,(H2,14,18)