6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 6-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H21N5O/c1-14-19(15(2)26-21(24-14)18(11-22)12-23-26)7-8-20(27)25-10-9-16-5-3-4-6-17(16)13-25/h3-6,12H,7-10,13H2,1-2H3