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

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(1-ethylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(1-ethylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(1-ethyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(1-ethylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(1-ethylimidazol-2-yl)thio]acetamide Formula: C13H13ClN4O3S MolecularWeight: 340.78532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H13ClN4O3S/c1-2-17-6-5-15-13(17)22-8-12(19)16-11-7-9(18(20)21)3-4-10(11)14/h3-7H,2,8H2,1H3,(H,16,19)