3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[3-(1-pyrazolylmethyl)phenyl]propanamide IUPAC Name: 3-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]propionamide Formula: C18H20ClN5O MolecularWeight: 357.8373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3)C)Cl

InChI

InChI=1S/C18H20ClN5O/c1-13-18(19)14(2)24(22-13)10-7-17(25)21-16-6-3-5-15(11-16)12-23-9-4-8-20-23/h3-6,8-9,11H,7,10,12H2,1-2H3,(H,21,25)