3-bromanyl-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(5-pyridin-3-ylpyridin-3-yl)amino]phenyl]benzamide

Systemtic Name: 3-bromanyl-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(5-pyridin-3-ylpyridin-3-yl)amino]phenyl]benzamide Openeye Name: 3-bromo-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[[5-(3-pyridyl)-3-pyridyl]amino]phenyl]benzamide CAS Name: 3-bromo-4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[5-(3-pyridinyl)-3-pyridinyl]amino]phenyl]benzamide IUPAC Name: 3-bromo-4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(5-pyridin-3-ylpyridin-3-yl)amino]phenyl]benzamide Traditional Name: 3-bromo-4-[(4-methylpiperazino)methyl]-N-[4-methyl-3-[[5-(3-pyridyl)-3-pyridyl]amino]phenyl]benzamide Formula: C30H31BrN6O MolecularWeight: 571.51074

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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=CN=CC(=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=CN=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C30H31BrN6O/c1-21-5-8-26(16-29(21)34-27-14-25(18-33-19-27)23-4-3-9-32-17-23)35-30(38)22-6-7-24(28(31)15-22)20-37-12-10-36(2)11-13-37/h3-9,14-19,34H,10-13,20H2,1-2H3,(H,35,38)