2-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propylsulfanyl]quinoline

Systemtic Name: 2-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propylsulfanyl]quinoline Openeye Name: 2-[3-(1-methyltetrazol-5-yl)sulfanylpropylsulfanyl]quinoline CAS Name: 2-[3-[(1-methyl-5-tetrazolyl)thio]propylthio]quinoline IUPAC Name: 2-[3-(1-methyltetrazol-5-yl)sulfanylpropylsulfanyl]quinoline Traditional Name: 2-[3-[(1-methyltetrazol-5-yl)thio]propylthio]quinoline Formula: C14H15N5S2 MolecularWeight: 317.4324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CN1C(=NN=N1)SCCCSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C14H15N5S2/c1-19-14(16-17-18-19)21-10-4-9-20-13-8-7-11-5-2-3-6-12(11)15-13/h2-3,5-8H,4,9-10H2,1H3