1-butyl-4-(phenylmethyl)-1,2,3,4-tetrazol-5-imine

Systemtic Name: 1-butyl-4-(phenylmethyl)-1,2,3,4-tetrazol-5-imine Openeye Name: 1-benzyl-4-butyl-tetrazol-5-imine CAS Name: 1-butyl-4-(phenylmethyl)-5-tetrazolimine IUPAC Name: 1-benzyl-4-butyltetrazol-5-imine Traditional Name: (1-benzyl-4-butyl-tetrazol-5-ylidene)amine Formula: C12H17N5 MolecularWeight: 231.29688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=N)N(N=N1)CC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=N)N(N=N1)CC2=CC=CC=C2

InChI

InChI=1S/C12H17N5/c1-2-3-9-16-12(13)17(15-14-16)10-11-7-5-4-6-8-11/h4-8,13H,2-3,9-10H2,1H3