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6-nitro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazole

6-nitro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name:6-nitro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazole
Openeye Name:6-nitro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazole
CAS Name:6-nitro-2-[(4-nitrophenyl)methylthio]-1,3-benzothiazole
IUPAC Name:6-nitro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazole
Traditional Name:6-nitro-2-[(4-nitrobenzyl)thio]-1,3-benzothiazole
Formula: C14H9N3O4S2
MolecularWeight: 347.36896
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C14H9N3O4S2/c18-16(19)10-3-1-9(2-4-10)8-22-14-15-12-6-5-11(17(20)21)7-13(12)23-14/h1-7H,8H2


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