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2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-1,3-benzothiazole

2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-1,3-benzothiazole

Systemtic Name:2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-1,3-benzothiazole
Openeye Name:2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-1,3-benzothiazole
CAS Name:2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-6-nitro-1,3-benzothiazole
IUPAC Name:2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-6-nitro-1,3-benzothiazole
Traditional Name:2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-6-nitro-1,3-benzothiazole
Formula: C11H9N5O2S2
MolecularWeight: 307.35146
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

CC1=NN=C(N1C)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C11H9N5O2S2/c1-6-13-14-10(15(6)2)20-11-12-8-4-3-7(16(17)18)5-9(8)19-11/h3-5H,1-2H3


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