N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]pyrimidin-4-yl]-2-methyl-benzene-1,4-diamine

Systemtic Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]pyrimidin-4-yl]-2-methyl-benzene-1,4-diamine Openeye Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]pyrimidin-4-yl]-2-methyl-benzene-1,4-diamine CAS Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)-3-methyl-1-piperazinyl]-4-pyrimidinyl]-2-methylbenzene-1,4-diamine IUPAC Name: 4-N,4-N-diethyl-1-N-[2-[4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]pyrimidin-4-yl]-2-methylbenzene-1,4-diamine Traditional Name: diethyl-[4-[[2-[4-(4-methoxyphenyl)-3-methyl-piperazino]pyrimidin-4-yl]amino]-3-methyl-phenyl]amine Formula: C27H36N6O MolecularWeight: 460.61434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC2=NC(=NC=C2)N3CCN(C(C3)C)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC2=NC(=NC=C2)N3CCN(C(C3)C)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C27H36N6O/c1-6-31(7-2)23-10-13-25(20(3)18-23)29-26-14-15-28-27(30-26)32-16-17-33(21(4)19-32)22-8-11-24(34-5)12-9-22/h8-15,18,21H,6-7,16-17,19H2,1-5H3,(H,28,29,30)