N-(2-chloranyl-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C16H13ClN4O3S MolecularWeight: 376.81742

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN4O3S/c1-20-14-5-3-2-4-12(14)19-16(20)25-9-15(22)18-13-8-10(21(23)24)6-7-11(13)17/h2-8H,9H2,1H3,(H,18,22)