2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide

Systemtic Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide Openeye Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N,N'-diphenyl-propanediamide CAS Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N,N'-diphenylpropanediamide IUPAC Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N,N'-diphenylpropanediamide Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N,N'-diphenyl-malonamide Formula: C22H17N5O4S MolecularWeight: 447.46648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(C(=O)NC2=CC=CC=C2)SC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(C(=O)NC2=CC=CC=C2)SC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O4S/c28-20(23-14-7-3-1-4-8-14)19(21(29)24-15-9-5-2-6-10-15)32-22-25-17-12-11-16(27(30)31)13-18(17)26-22/h1-13,19H,(H,23,28)(H,24,29)(H,25,26)