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2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-6-nitro-1,3-benzothiazole

2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-6-nitro-1,3-benzothiazole

Systemtic Name:2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-6-nitro-1,3-benzothiazole
Openeye Name:2-(1-tert-butyltetrazol-5-yl)sulfanyl-6-nitro-1,3-benzothiazole
CAS Name:2-[(1-tert-butyl-5-tetrazolyl)thio]-6-nitro-1,3-benzothiazole
IUPAC Name:2-(1-tert-butyltetrazol-5-yl)sulfanyl-6-nitro-1,3-benzothiazole
Traditional Name:2-[(1-tert-butyltetrazol-5-yl)thio]-6-nitro-1,3-benzothiazole
Formula: C12H12N6O2S2
MolecularWeight: 336.39268
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C12H12N6O2S2/c1-12(2,3)17-10(14-15-16-17)22-11-13-8-5-4-7(18(19)20)6-9(8)21-11/h4-6H,1-3H3


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