3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-3,5-dimethyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3,5-dimethyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-3,5-dimethylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C20H24N4O MolecularWeight: 336.43076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H24N4O/c1-15-19(16(2)24(22-15)12-5-11-21)8-9-20(25)23-13-10-17-6-3-4-7-18(17)14-23/h3-4,6-7H,5,8-10,12-14H2,1-2H3