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4-(1H-benzimidazol-2-ylsulfanylmethyl)-3-nitro-benzamide

4-(1H-benzimidazol-2-ylsulfanylmethyl)-3-nitro-benzamide

Systemtic Name:4-(1H-benzimidazol-2-ylsulfanylmethyl)-3-nitro-benzamide
Openeye Name:4-(1H-benzimidazol-2-ylsulfanylmethyl)-3-nitro-benzamide
CAS Name:4-[(1H-benzimidazol-2-ylthio)methyl]-3-nitrobenzamide
IUPAC Name:4-(1H-benzimidazol-2-ylsulfanylmethyl)-3-nitrobenzamide
Traditional Name:4-[(1H-benzimidazol-2-ylthio)methyl]-3-nitro-benzamide
Formula: C15H12N4O3S
MolecularWeight: 328.34578
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]


InChI

InChI=1S/C15H12N4O3S/c16-14(20)9-5-6-10(13(7-9)19(21)22)8-23-15-17-11-3-1-2-4-12(11)18-15/h1-7H,8H2,(H2,16,20)(H,17,18)


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