N-(6-nitro-1,3-benzothiazol-2-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-[(1-phenylbenzimidazol-2-yl)thio]acetamide Formula: C22H15N5O3S2 MolecularWeight: 461.5162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O3S2/c28-20(25-21-23-17-11-10-15(27(29)30)12-19(17)32-21)13-31-22-24-16-8-4-5-9-18(16)26(22)14-6-2-1-3-7-14/h1-12H,13H2,(H,23,25,28)