N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(3-bromophenyl)thiazol-2-yl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[4-(3-bromophenyl)-2-thiazolyl]-2-[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylacetamide Traditional Name: N-[4-(3-bromophenyl)thiazol-2-yl]-2-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]acetamide Formula: C25H18BrN5O4S2 MolecularWeight: 596.47552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=NC(=CS4)C5=CC(=CC=C5)Br

Isomeric SMILES

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=NC(=CS4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C25H18BrN5O4S2/c1-35-22-8-3-2-7-21(22)30-20-10-9-17(31(33)34)12-18(20)28-25(30)37-14-23(32)29-24-27-19(13-36-24)15-5-4-6-16(26)11-15/h2-13H,14H2,1H3,(H,27,29,32)