N-(4-bromanyl-3-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C17H20BrN5O MolecularWeight: 390.2776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)C3=NC=CC=N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)C3=NC=CC=N3)Br

InChI

InChI=1S/C17H20BrN5O/c1-13-11-14(3-4-15(13)18)21-16(24)12-22-7-9-23(10-8-22)17-19-5-2-6-20-17/h2-6,11H,7-10,12H2,1H3,(H,21,24)