3-[5-(2-methyl-1,3-thiazol-4-yl)-1,2,3,4-tetrazol-2-yl]benzenecarbonitrile

Systemtic Name: 3-[5-(2-methyl-1,3-thiazol-4-yl)-1,2,3,4-tetrazol-2-yl]benzenecarbonitrile Openeye Name: 3-[5-(2-methylthiazol-4-yl)tetrazol-2-yl]benzonitrile CAS Name: 3-[5-(2-methyl-4-thiazolyl)-2-tetrazolyl]benzonitrile IUPAC Name: 3-[5-(2-methyl-1,3-thiazol-4-yl)tetrazol-2-yl]benzonitrile Traditional Name: 3-[5-(2-methylthiazol-4-yl)tetrazol-2-yl]benzonitrile Formula: C12H8N6S MolecularWeight: 268.29712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=NN(N=N2)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=NC(=CS1)C2=NN(N=N2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C12H8N6S/c1-8-14-11(7-19-8)12-15-17-18(16-12)10-4-2-3-9(5-10)6-13/h2-5,7H,1H3