3-[methyl-(1-phenyl-1,2,3,4-tetrazol-5-yl)amino]propanenitrile

Systemtic Name: 3-[methyl-(1-phenyl-1,2,3,4-tetrazol-5-yl)amino]propanenitrile Openeye Name: 3-[methyl-(1-phenyltetrazol-5-yl)amino]propanenitrile CAS Name: 3-[methyl-(1-phenyl-5-tetrazolyl)amino]propanenitrile IUPAC Name: 3-[methyl-(1-phenyltetrazol-5-yl)amino]propanenitrile Traditional Name: 3-[methyl-(1-phenyltetrazol-5-yl)amino]propionitrile Formula: C11H12N6 MolecularWeight: 228.25318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CN(CCC#N)C1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C11H12N6/c1-16(9-5-8-12)11-13-14-15-17(11)10-6-3-2-4-7-10/h2-4,6-7H,5,9H2,1H3