N-(4-ethoxy-2-nitro-phenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-3-29-14-8-9-16(18(12-14)24(26)27)21-19(25)13-30-20-22-15-6-4-5-7-17(15)23(20)10-11-28-2/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,25)