3-bromanyl-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(6-pyridin-3-ylpyrazin-2-yl)amino]phenyl]benzamide

Systemtic Name: 3-bromanyl-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(6-pyridin-3-ylpyrazin-2-yl)amino]phenyl]benzamide Openeye Name: 3-bromo-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[[6-(3-pyridyl)pyrazin-2-yl]amino]phenyl]benzamide CAS Name: 3-bromo-4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[6-(3-pyridinyl)-2-pyrazinyl]amino]phenyl]benzamide IUPAC Name: 3-bromo-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(6-pyridin-3-ylpyrazin-2-yl)amino]phenyl]benzamide Traditional Name: 3-bromo-4-[(4-methylpiperazino)methyl]-N-[4-methyl-3-[[6-(3-pyridyl)pyrazin-2-yl]amino]phenyl]benzamide Formula: C29H30BrN7O MolecularWeight: 572.4988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCN(CC3)C)Br)NC4=NC(=CN=C4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CCN(CC3)C)Br)NC4=NC(=CN=C4)C5=CN=CC=C5

InChI

InChI=1S/C29H30BrN7O/c1-20-5-8-24(15-26(20)34-28-18-32-17-27(35-28)22-4-3-9-31-16-22)33-29(38)21-6-7-23(25(30)14-21)19-37-12-10-36(2)11-13-37/h3-9,14-18H,10-13,19H2,1-2H3,(H,33,38)(H,34,35)