2-[[1-(5-methylsulfonylpentyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[1-(5-methylsulfonylpentyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1,3-benzothiazole Openeye Name: 2-[1-(5-methylsulfonylpentyl)tetrazol-5-yl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[1-(5-methylsulfonylpentyl)-5-tetrazolyl]thio]-1,3-benzothiazole IUPAC Name: 2-[1-(5-methylsulfonylpentyl)tetrazol-5-yl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[1-(5-mesylpentyl)tetrazol-5-yl]thio]-1,3-benzothiazole Formula: C14H17N5O2S3 MolecularWeight: 383.51208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCCN1C(=NN=N1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CS(=O)(=O)CCCCCN1C(=NN=N1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H17N5O2S3/c1-24(20,21)10-6-2-5-9-19-13(16-17-18-19)23-14-15-11-7-3-4-8-12(11)22-14/h3-4,7-8H,2,5-6,9-10H2,1H3