4-(1-benzothiophen-2-yl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine

Systemtic Name: 4-(1-benzothiophen-2-yl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine Openeye Name: 4-(benzothiophen-2-yl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine CAS Name: 4-(1-benzothiophen-2-yl)-5-methyl-N-[4-(4-methyl-1-piperazinyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(1-benzothiophen-2-yl)-5-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine Traditional Name: [4-(benzothiophen-2-yl)-5-methyl-pyrimidin-2-yl]-[4-(4-methylpiperazino)phenyl]amine Formula: C24H25N5S MolecularWeight: 415.5538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC3=CC=CC=C3S2)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=CN=C(N=C1C2=CC3=CC=CC=C3S2)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C24H25N5S/c1-17-16-25-24(27-23(17)22-15-18-5-3-4-6-21(18)30-22)26-19-7-9-20(10-8-19)29-13-11-28(2)12-14-29/h3-10,15-16H,11-14H2,1-2H3,(H,25,26,27)