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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CCN)CC)CC2=CC(=CC(=C2)C#N)[N+]#[C-]

Isomeric SMILES

CCC1=C(C(=NN1CCN)CC)CC2=CC(=CC(=C2)C#N)[N+]#[C-]

InChI

InChI=1S/C18H21N5/c1-4-17-16(18(5-2)23(22-17)7-6-19)11-13-8-14(12-20)10-15(9-13)21-3/h8-10H,4-7,11,19H2,1-2H3