5-bromanyl-N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[3-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[3-chloro-2-(4-isobutyrylpiperazino)phenyl]nicotinamide Formula: C20H22BrClN4O2 MolecularWeight: 465.77128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C20H22BrClN4O2/c1-13(2)20(28)26-8-6-25(7-9-26)18-16(22)4-3-5-17(18)24-19(27)14-10-15(21)12-23-11-14/h3-5,10-13H,6-9H2,1-2H3,(H,24,27)