6-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanylpyridine-3-carbonitrile CAS Name: 6-[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanylpyridine-3-carbonitrile Traditional Name: 6-[(1-p-cumenyltetrazol-5-yl)thio]nicotinonitrile Formula: C16H14N6S MolecularWeight: 322.38756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC=C(C=C3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SC3=NC=C(C=C3)C#N

InChI

InChI=1S/C16H14N6S/c1-11(2)13-4-6-14(7-5-13)22-16(19-20-21-22)23-15-8-3-12(9-17)10-18-15/h3-8,10-11H,1-2H3