2-[[1-(5-bromanylthiophen-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-6-methylsulfonyl-1,3-benzothiazole

Systemtic Name: 2-[[1-(5-bromanylthiophen-2-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-6-methylsulfonyl-1,3-benzothiazole Openeye Name: 2-[1-(5-bromo-2-thienyl)tetrazol-5-yl]sulfanyl-6-methylsulfonyl-1,3-benzothiazole CAS Name: 2-[[1-(5-bromo-2-thiophenyl)-5-tetrazolyl]thio]-6-methylsulfonyl-1,3-benzothiazole IUPAC Name: 2-[1-(5-bromothiophen-2-yl)tetrazol-5-yl]sulfanyl-6-methylsulfonyl-1,3-benzothiazole Traditional Name: 2-[[1-(5-bromo-2-thienyl)tetrazol-5-yl]thio]-6-mesyl-1,3-benzothiazole Formula: C13H8BrN5O2S4 MolecularWeight: 474.39892

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NN=NN3C4=CC=C(S4)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NN=NN3C4=CC=C(S4)Br

InChI

InChI=1S/C13H8BrN5O2S4/c1-25(20,21)7-2-3-8-9(6-7)22-13(15-8)24-12-16-17-18-19(12)11-5-4-10(14)23-11/h2-6H,1H3