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4-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]quinazoline

4-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]quinazoline

Systemtic Name:4-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]quinazoline
Openeye Name:4-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]quinazoline
CAS Name:4-[(6-nitro-1H-benzimidazol-2-yl)methylthio]quinazoline
IUPAC Name:4-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]quinazoline
Traditional Name:4-[(6-nitro-1H-benzimidazol-2-yl)methylthio]quinazoline
Formula: C16H11N5O2S
MolecularWeight: 337.35584
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]


InChI

InChI=1S/C16H11N5O2S/c22-21(23)10-5-6-13-14(7-10)20-15(19-13)8-24-16-11-3-1-2-4-12(11)17-9-18-16/h1-7,9H,8H2,(H,19,20)


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