2-[[1-(2-azanylethyl)-3,5-diethyl-pyrazol-4-yl]methyl]benzene-1,3-dicarbonitrile

Systemtic Name: 2-[[1-(2-azanylethyl)-3,5-diethyl-pyrazol-4-yl]methyl]benzene-1,3-dicarbonitrile Openeye Name: 2-[[1-(2-aminoethyl)-3,5-diethyl-pyrazol-4-yl]methyl]benzene-1,3-dicarbonitrile CAS Name: 2-[[1-(2-aminoethyl)-3,5-diethyl-4-pyrazolyl]methyl]benzene-1,3-dicarbonitrile IUPAC Name: 2-[[1-(2-aminoethyl)-3,5-diethylpyrazol-4-yl]methyl]benzene-1,3-dicarbonitrile Traditional Name: 2-[[1-(2-aminoethyl)-3,5-diethyl-pyrazol-4-yl]methyl]isophthalonitrile Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCN)CC)CC2=C(C=CC=C2C#N)C#N

Isomeric SMILES

CCC1=C(C(=NN1CCN)CC)CC2=C(C=CC=C2C#N)C#N

InChI

InChI=1S/C18H21N5/c1-3-17-16(18(4-2)23(22-17)9-8-19)10-15-13(11-20)6-5-7-14(15)12-21/h5-7H,3-4,8-10,19H2,1-2H3