5-chloranyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1,3-dimethylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1,3-dimethyl-pyrazole-4-carboxamide Formula: C22H20ClN5O MolecularWeight: 405.8801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)Cl)C

InChI

InChI=1S/C22H20ClN5O/c1-15-19(21(23)27(2)25-15)22(29)24-13-17-14-28(18-11-7-4-8-12-18)26-20(17)16-9-5-3-6-10-16/h3-12,14H,13H2,1-2H3,(H,24,29)