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

Systemtic Name: 2-[[1-(3-methoxypropyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-6-methylsulfonyl-1,3-benzothiazole Openeye Name: 2-[1-(3-methoxypropyl)tetrazol-5-yl]sulfanyl-6-methylsulfonyl-1,3-benzothiazole CAS Name: 2-[[1-(3-methoxypropyl)-5-tetrazolyl]thio]-6-methylsulfonyl-1,3-benzothiazole IUPAC Name: 2-[1-(3-methoxypropyl)tetrazol-5-yl]sulfanyl-6-methylsulfonyl-1,3-benzothiazole Traditional Name: 6-mesyl-2-[[1-(3-methoxypropyl)tetrazol-5-yl]thio]-1,3-benzothiazole Formula: C13H15N5O3S3 MolecularWeight: 385.4849

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=N1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COCCCN1C(=NN=N1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C13H15N5O3S3/c1-21-7-3-6-18-12(15-16-17-18)23-13-14-10-5-4-9(24(2,19)20)8-11(10)22-13/h4-5,8H,3,6-7H2,1-2H3