3-chloranyl-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1-(2-hydroxyethyl)-3-methyl-pyrazol-4-yl]oxy-benzenecarbonitrile

Systemtic Name: 3-chloranyl-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1-(2-hydroxyethyl)-3-methyl-pyrazol-4-yl]oxy-benzenecarbonitrile Openeye Name: 3-chloro-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1-(2-hydroxyethyl)-3-methyl-pyrazol-4-yl]oxy-benzonitrile CAS Name: 3-chloro-5-[[5-[[(4-cyanophenyl)methylamino]methyl]-1-(2-hydroxyethyl)-3-methyl-4-pyrazolyl]oxy]benzonitrile IUPAC Name: 3-chloro-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]oxybenzonitrile Traditional Name: 3-chloro-5-[5-[[(4-cyanobenzyl)amino]methyl]-1-(2-hydroxyethyl)-3-methyl-pyrazol-4-yl]oxy-benzonitrile Formula: C22H20ClN5O2 MolecularWeight: 421.8795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1OC2=CC(=CC(=C2)C#N)Cl)CNCC3=CC=C(C=C3)C#N)CCO

Isomeric SMILES

CC1=NN(C(=C1OC2=CC(=CC(=C2)C#N)Cl)CNCC3=CC=C(C=C3)C#N)CCO

InChI

InChI=1S/C22H20ClN5O2/c1-15-22(30-20-9-18(12-25)8-19(23)10-20)21(28(27-15)6-7-29)14-26-13-17-4-2-16(11-24)3-5-17/h2-5,8-10,26,29H,6-7,13-14H2,1H3