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

Systemtic Name: 2-[[[4-methyl-3-(1,2,3,4-tetrazol-1-yl)phenyl]amino]methyl]benzenecarbonitrile Openeye Name: 2-[[4-methyl-3-(tetrazol-1-yl)anilino]methyl]benzonitrile CAS Name: 2-[[4-methyl-3-(1-tetrazolyl)anilino]methyl]benzonitrile IUPAC Name: 2-[[4-methyl-3-(tetrazol-1-yl)anilino]methyl]benzonitrile Traditional Name: 2-[[4-methyl-3-(tetrazol-1-yl)anilino]methyl]benzonitrile Formula: C16H14N6 MolecularWeight: 290.32256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC=CC=C2C#N)N3C=NN=N3

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC=CC=C2C#N)N3C=NN=N3

InChI

InChI=1S/C16H14N6/c1-12-6-7-15(8-16(12)22-11-19-20-21-22)18-10-14-5-3-2-4-13(14)9-17/h2-8,11,18H,10H2,1H3