4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyrazin-2-yl-1,3-thiazol-2-yl)amino]phenyl]benzamide

Systemtic Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyrazin-2-yl-1,3-thiazol-2-yl)amino]phenyl]benzamide Openeye Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyrazin-2-ylthiazol-2-yl)amino]phenyl]benzamide CAS Name: 4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(2-pyrazinyl)-2-thiazolyl]amino]phenyl]benzamide IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyrazin-2-yl-1,3-thiazol-2-yl)amino]phenyl]benzamide Traditional Name: 4-[(4-methylpiperazino)methyl]-N-[4-methyl-3-[(4-pyrazin-2-ylthiazol-2-yl)amino]phenyl]benzamide Formula: C27H29N7OS MolecularWeight: 499.63046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC(=CS4)C5=NC=CN=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC(=CS4)C5=NC=CN=C5

InChI

InChI=1S/C27H29N7OS/c1-19-3-8-22(15-23(19)31-27-32-25(18-36-27)24-16-28-9-10-29-24)30-26(35)21-6-4-20(5-7-21)17-34-13-11-33(2)12-14-34/h3-10,15-16,18H,11-14,17H2,1-2H3,(H,30,35)(H,31,32)