N-(2-cyanoethyl)-N,5-dimethyl-6-[(3-methylphenyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(2-cyanoethyl)-N,5-dimethyl-6-[(3-methylphenyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-(2-cyanoethyl)-N,5-dimethyl-6-(m-tolylmethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-(2-cyanoethyl)-N,5-dimethyl-6-[(3-methylphenyl)methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide IUPAC Name: N-(2-cyanoethyl)-N,5-dimethyl-6-[(3-methylphenyl)methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-(2-cyanoethyl)-7-keto-N,5-dimethyl-6-(3-methylbenzyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C3C(=CNN3C2=O)C(=O)N(C)CCC#N)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C3C(=CNN3C2=O)C(=O)N(C)CCC#N)C

InChI

InChI=1S/C20H21N5O2/c1-13-6-4-7-15(10-13)11-16-14(2)23-18-17(12-22-25(18)20(16)27)19(26)24(3)9-5-8-21/h4,6-7,10,12,22H,5,9,11H2,1-3H3