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

Systemtic Name: 4,6-dimethyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-(1-phenyltetrazol-5-yl)sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[(1-phenyl-5-tetrazolyl)thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-(1-phenyltetrazol-5-yl)sulfanylpyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-[(1-phenyltetrazol-5-yl)thio]nicotinonitrile Formula: C15H12N6S MolecularWeight: 308.36098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=NN=NN2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=NN=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C15H12N6S/c1-10-8-11(2)17-14(13(10)9-16)22-15-18-19-20-21(15)12-6-4-3-5-7-12/h3-8H,1-2H3