N-(5-bromanylpyridin-2-yl)-5-methyl-2-[4-[C-(4-methyl-1,4-diazepan-1-yl)carbonimidoyl]phenyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-5-methyl-2-[4-[C-(4-methyl-1,4-diazepan-1-yl)carbonimidoyl]phenyl]pyrazole-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-5-methyl-2-[4-(4-methyl-1,4-diazepane-1-carboximidoyl)phenyl]pyrazole-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[4-[imino-(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-5-methyl-2-[4-(4-methyl-1,4-diazepane-1-carboximidoyl)phenyl]pyrazole-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-5-methyl-2-[4-(4-methyl-1,4-diazepane-1-carboximidoyl)phenyl]pyrazole-3-carboxamide Formula: C23H26BrN7O MolecularWeight: 496.40284

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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)N4CCCN(CC4)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=NC=C(C=C2)Br)C3=CC=C(C=C3)C(=N)N4CCCN(CC4)C

InChI

InChI=1S/C23H26BrN7O/c1-16-14-20(23(32)27-21-9-6-18(24)15-26-21)31(28-16)19-7-4-17(5-8-19)22(25)30-11-3-10-29(2)12-13-30/h4-9,14-15,25H,3,10-13H2,1-2H3,(H,26,27,32)