7-azanyl-6-(4-chlorophenyl)carbonyl-5-ethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 7-azanyl-6-(4-chlorophenyl)carbonyl-5-ethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 7-amino-6-(4-chlorobenzoyl)-5-ethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 7-amino-6-[(4-chlorophenyl)-oxomethyl]-5-ethyl-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 7-amino-6-(4-chlorobenzoyl)-5-ethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 7-amino-6-(4-chlorobenzoyl)-5-ethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C16H12ClN5O MolecularWeight: 325.75238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C(=C1C(=O)C3=CC=C(C=C3)Cl)N)C#N

Isomeric SMILES

CCC1=NC2=C(C=NN2C(=C1C(=O)C3=CC=C(C=C3)Cl)N)C#N

InChI

InChI=1S/C16H12ClN5O/c1-2-12-13(14(23)9-3-5-11(17)6-4-9)15(19)22-16(21-12)10(7-18)8-20-22/h3-6,8H,2,19H2,1H3