4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzonitrile CAS Name: 4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzonitrile IUPAC Name: 4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzonitrile Traditional Name: 4-[2-bromoethyl(1,2,4-triazol-4-yl)amino]benzonitrile Formula: C11H10BrN5 MolecularWeight: 292.1346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N(CCBr)N2C=NN=C2

Isomeric SMILES

C1=CC(=CC=C1C#N)N(CCBr)N2C=NN=C2

InChI

InChI=1S/C11H10BrN5/c12-5-6-17(16-8-14-15-9-16)11-3-1-10(7-13)2-4-11/h1-4,8-9H,5-6H2