N-(5-bromanylpyridin-2-yl)-5-methyl-2-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-5-methyl-2-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]pyrazole-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-5-methyl-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]pyrazole-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[4-[imino(1-pyrrolidinyl)methyl]phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-5-methyl-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]pyrazole-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-5-methyl-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]pyrazole-3-carboxamide Formula: C21H21BrN6O MolecularWeight: 453.33504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=NC=C(C=C2)Br)C3=CC=C(C=C3)C(=N)N4CCCC4

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=NC=C(C=C2)Br)C3=CC=C(C=C3)C(=N)N4CCCC4

InChI

InChI=1S/C21H21BrN6O/c1-14-12-18(21(29)25-19-9-6-16(22)13-24-19)28(26-14)17-7-4-15(5-8-17)20(23)27-10-2-3-11-27/h4-9,12-13,23H,2-3,10-11H2,1H3,(H,24,25,29)