1-(4-bromophenyl)-5-methyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-5-methyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-5-methyl-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-5-methyl-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-5-methyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-5-methyl-N-[(6-pyrrolidino-3-pyridyl)methyl]pyrazole-4-carboxamide Formula: C21H22BrN5O MolecularWeight: 440.33628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCC3=CN=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)NCC3=CN=C(C=C3)N4CCCC4

InChI

InChI=1S/C21H22BrN5O/c1-15-19(14-25-27(15)18-7-5-17(22)6-8-18)21(28)24-13-16-4-9-20(23-12-16)26-10-2-3-11-26/h4-9,12,14H,2-3,10-11,13H2,1H3,(H,24,28)