2-ethyl-8-(1-methylpyrazol-4-yl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile

Systemtic Name: 2-ethyl-8-(1-methylpyrazol-4-yl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Openeye Name: 2-ethyl-8-(1-methylpyrazol-4-yl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile CAS Name: 2-ethyl-8-(1-methyl-4-pyrazolyl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile IUPAC Name: 2-ethyl-8-(1-methylpyrazol-4-yl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Traditional Name: 2-ethyl-8-(1-methylpyrazol-4-yl)-5-phenyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Formula: C22H22N4 MolecularWeight: 342.43688

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C=C(C(=C2C1)C3=CN(N=C3)C)C#N)C4=CC=CC=C4

Isomeric SMILES

CCN1CCC2=C(C=C(C(=C2C1)C3=CN(N=C3)C)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4/c1-3-26-10-9-19-20(16-7-5-4-6-8-16)11-17(12-23)22(21(19)15-26)18-13-24-25(2)14-18/h4-8,11,13-14H,3,9-10,15H2,1-2H3