4-(2-chloranylethanoyl)-7-(3-methylphenyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 4-(2-chloranylethanoyl)-7-(3-methylphenyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 4-(2-chloroacetyl)-7-(m-tolyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 4-(2-chloro-1-oxoethyl)-7-(3-methylphenyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile IUPAC Name: 4-(2-chloroacetyl)-7-(3-methylphenyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 4-(2-chloroacetyl)-7-(m-tolyl)-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C16H13ClN4O MolecularWeight: 312.75362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CCN(C3=C(C=NN23)C#N)C(=O)CCl

Isomeric SMILES

CC1=CC=CC(=C1)C2=CCN(C3=C(C=NN23)C#N)C(=O)CCl

InChI

InChI=1S/C16H13ClN4O/c1-11-3-2-4-12(7-11)14-5-6-20(15(22)8-17)16-13(9-18)10-19-21(14)16/h2-5,7,10H,6,8H2,1H3