5-chloranyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[[4-(1-imidazolylmethyl)phenyl]methyl]-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-1,3-dimethylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[4-(imidazol-1-ylmethyl)benzyl]-1,3-dimethyl-pyrazole-4-carboxamide Formula: C17H18ClN5O MolecularWeight: 343.81072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)CN3C=CN=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)CN3C=CN=C3)Cl)C

InChI

InChI=1S/C17H18ClN5O/c1-12-15(16(18)22(2)21-12)17(24)20-9-13-3-5-14(6-4-13)10-23-8-7-19-11-23/h3-8,11H,9-10H2,1-2H3,(H,20,24)