1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-(4-bromo-3-methyl-phenyl)-5-oxo-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide CAS Name: 1-(4-bromo-3-methylphenyl)-5-oxo-N-[3-(1-pyrazolylmethyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-oxo-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-(4-bromo-3-methyl-phenyl)-5-keto-N-[3-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Formula: C22H21BrN4O2 MolecularWeight: 453.33174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)CN4C=CC=N4)Br

InChI

InChI=1S/C22H21BrN4O2/c1-15-10-19(6-7-20(15)23)27-14-17(12-21(27)28)22(29)25-18-5-2-4-16(11-18)13-26-9-3-8-24-26/h2-11,17H,12-14H2,1H3,(H,25,29)