2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]quinoline

Systemtic Name: 2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]quinoline Openeye Name: 2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanylquinoline CAS Name: 2-[[1-(2,6-dimethylphenyl)-5-tetrazolyl]thio]quinoline IUPAC Name: 2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanylquinoline Traditional Name: 2-[[1-(2,6-dimethylphenyl)tetrazol-5-yl]thio]quinoline Formula: C18H15N5S MolecularWeight: 333.4102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C18H15N5S/c1-12-6-5-7-13(2)17(12)23-18(20-21-22-23)24-16-11-10-14-8-3-4-9-15(14)19-16/h3-11H,1-2H3