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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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