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

Systemtic Name: 2-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]quinoline Openeye Name: 2-[1-(o-tolyl)tetrazol-5-yl]sulfanylquinoline CAS Name: 2-[[1-(2-methylphenyl)-5-tetrazolyl]thio]quinoline IUPAC Name: 2-[1-(2-methylphenyl)tetrazol-5-yl]sulfanylquinoline Traditional Name: 2-[[1-(o-tolyl)tetrazol-5-yl]thio]quinoline Formula: C17H13N5S MolecularWeight: 319.38362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C17H13N5S/c1-12-6-2-5-9-15(12)22-17(19-20-21-22)23-16-11-10-13-7-3-4-8-14(13)18-16/h2-11H,1H3