5-azanyl-1-(2-chloranylethynyl)pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-(2-chloranylethynyl)pyrazole-3-carbonitrile Openeye Name: 5-amino-1-(2-chloroethynyl)pyrazole-3-carbonitrile CAS Name: 5-amino-1-(2-chloroethynyl)-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-chloroethynyl)pyrazole-3-carbonitrile Traditional Name: 5-amino-1-(2-chloroethynyl)pyrazole-3-carbonitrile Formula: C6H3ClN4 MolecularWeight: 166.56782

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N(N=C1C#N)C#CCl)N

Isomeric SMILES

C1=C(N(N=C1C#N)C#CCl)N

InChI

InChI=1S/C6H3ClN4/c7-1-2-11-6(9)3-5(4-8)10-11/h3H,9H2