5-[1-(2-azanylethyl)-3-tert-butyl-5-methyl-pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile

Systemtic Name: 5-[1-(2-azanylethyl)-3-tert-butyl-5-methyl-pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile Openeye Name: 5-[1-(2-aminoethyl)-3-tert-butyl-5-methyl-pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile CAS Name: 5-[[1-(2-aminoethyl)-3-tert-butyl-5-methyl-4-pyrazolyl]oxy]benzene-1,3-dicarbonitrile IUPAC Name: 5-[1-(2-aminoethyl)-3-tert-butyl-5-methylpyrazol-4-yl]oxybenzene-1,3-dicarbonitrile Traditional Name: 5-[1-(2-aminoethyl)-3-tert-butyl-5-methyl-pyrazol-4-yl]oxyisophthalonitrile Formula: C18H21N5O MolecularWeight: 323.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCN)C(C)(C)C)OC2=CC(=CC(=C2)C#N)C#N

Isomeric SMILES

CC1=C(C(=NN1CCN)C(C)(C)C)OC2=CC(=CC(=C2)C#N)C#N

InChI

InChI=1S/C18H21N5O/c1-12-16(17(18(2,3)4)22-23(12)6-5-19)24-15-8-13(10-20)7-14(9-15)11-21/h7-9H,5-6,19H2,1-4H3