3-[5-(1,3-benzothiazol-2-ylsulfanyl)-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-[5-(1,3-benzothiazol-2-ylsulfanyl)-1,2,3,4-tetrazol-1-yl]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[5-(1,3-benzothiazol-2-ylsulfanyl)tetrazol-1-yl]-N,N-dimethyl-propan-1-amine CAS Name: 3-[5-(1,3-benzothiazol-2-ylthio)-1-tetrazolyl]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[5-(1,3-benzothiazol-2-ylsulfanyl)tetrazol-1-yl]-N,N-dimethylpropan-1-amine Traditional Name: 3-[5-(1,3-benzothiazol-2-ylthio)tetrazol-1-yl]propyl-dimethyl-amine Formula: C13H16N6S2 MolecularWeight: 320.43634

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=NN=N1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)CCCN1C(=NN=N1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H16N6S2/c1-18(2)8-5-9-19-12(15-16-17-19)21-13-14-10-6-3-4-7-11(10)20-13/h3-4,6-7H,5,8-9H2,1-2H3