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

Systemtic Name: 3-chloranyl-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1,3-dimethyl-pyrazol-4-yl]oxy-benzenecarbonitrile Openeye Name: 3-chloro-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1,3-dimethyl-pyrazol-4-yl]oxy-benzonitrile CAS Name: 3-chloro-5-[[5-[[(4-cyanophenyl)methylamino]methyl]-1,3-dimethyl-4-pyrazolyl]oxy]benzonitrile IUPAC Name: 3-chloro-5-[5-[[(4-cyanophenyl)methylamino]methyl]-1,3-dimethylpyrazol-4-yl]oxybenzonitrile Traditional Name: 3-chloro-5-[5-[[(4-cyanobenzyl)amino]methyl]-1,3-dimethyl-pyrazol-4-yl]oxy-benzonitrile Formula: C21H18ClN5O MolecularWeight: 391.85352

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN5O/c1-14-21(28-19-8-17(11-24)7-18(22)9-19)20(27(2)26-14)13-25-12-16-5-3-15(10-23)4-6-16/h3-9,25H,12-13H2,1-2H3