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

Systemtic Name: 6-nitro-2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1,3-benzothiazole Openeye Name: 6-nitro-2-[1-(2-thienylmethyl)tetrazol-5-yl]sulfanyl-1,3-benzothiazole CAS Name: 6-nitro-2-[[1-(thiophen-2-ylmethyl)-5-tetrazolyl]thio]-1,3-benzothiazole IUPAC Name: 6-nitro-2-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]sulfanyl-1,3-benzothiazole Traditional Name: 6-nitro-2-[[1-(2-thenyl)tetrazol-5-yl]thio]-1,3-benzothiazole Formula: C13H8N6O2S3 MolecularWeight: 376.43662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=NN=N2)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CN2C(=NN=N2)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C13H8N6O2S3/c20-19(21)8-3-4-10-11(6-8)23-13(14-10)24-12-15-16-17-18(12)7-9-2-1-5-22-9/h1-6H,7H2