2-[(4-chlorophenyl)-(1H-1,2,4-triazol-5-yl)amino]ethanenitrile

Systemtic Name: 2-[(4-chlorophenyl)-(1H-1,2,4-triazol-5-yl)amino]ethanenitrile Openeye Name: 2-[4-chloro-N-(1H-1,2,4-triazol-5-yl)anilino]acetonitrile CAS Name: 2-[4-chloro-N-(1H-1,2,4-triazol-5-yl)anilino]acetonitrile IUPAC Name: 2-[4-chloro-N-(1H-1,2,4-triazol-5-yl)anilino]acetonitrile Traditional Name: 2-[4-chloro-N-(1H-1,2,4-triazol-5-yl)anilino]acetonitrile Formula: C10H8ClN5 MolecularWeight: 233.65702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(CC#N)C2=NC=NN2)Cl

Isomeric SMILES

C1=CC(=CC=C1N(CC#N)C2=NC=NN2)Cl

InChI

InChI=1S/C10H8ClN5/c11-8-1-3-9(4-2-8)16(6-5-12)10-13-7-14-15-10/h1-4,7H,6H2,(H,13,14,15)