3-azanyl-2,6-dimethyl-N-[2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-5-yl]benzamide

Systemtic Name: 3-azanyl-2,6-dimethyl-N-[2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-5-yl]benzamide Openeye Name: 3-amino-2,6-dimethyl-N-[2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-5-yl]benzamide CAS Name: 3-amino-2,6-dimethyl-N-[2-[4-(4-methyl-1-piperazinyl)anilino]-5-pyrimidinyl]benzamide IUPAC Name: 3-amino-2,6-dimethyl-N-[2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-5-yl]benzamide Traditional Name: 3-amino-2,6-dimethyl-N-[2-[4-(4-methylpiperazino)anilino]pyrimidin-5-yl]benzamide Formula: C24H29N7O MolecularWeight: 431.53336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)N)C)C(=O)NC2=CN=C(N=C2)NC3=CC=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CC1=C(C(=C(C=C1)N)C)C(=O)NC2=CN=C(N=C2)NC3=CC=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C24H29N7O/c1-16-4-9-21(25)17(2)22(16)23(32)28-19-14-26-24(27-15-19)29-18-5-7-20(8-6-18)31-12-10-30(3)11-13-31/h4-9,14-15H,10-13,25H2,1-3H3,(H,28,32)(H,26,27,29)