2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylpyridine-3-carbonitrile CAS Name: 2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]nicotinonitrile Formula: C13H7ClN6S MolecularWeight: 314.75288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=NN=NN2C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC(=C(N=C1)SC2=NN=NN2C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C13H7ClN6S/c14-10-3-5-11(6-4-10)20-13(17-18-19-20)21-12-9(8-15)2-1-7-16-12/h1-7H