N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(methylthio)-3-nitro-benzamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-25-15-7-6-11(10-14(15)21(23)24)17(22)18-9-8-16-19-12-4-2-3-5-13(12)20-16/h2-7,10H,8-9H2,1H3,(H,18,22)(H,19,20)