N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl]-2,5-dimethyl-benzene-1,4-diamine

Systemtic Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl]-2,5-dimethyl-benzene-1,4-diamine Openeye Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl]-2,5-dimethyl-benzene-1,4-diamine CAS Name: N4,N4-diethyl-N1-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-pyrimidinyl]-2,5-dimethylbenzene-1,4-diamine IUPAC Name: 4-N,4-N-diethyl-1-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl]-2,5-dimethylbenzene-1,4-diamine Traditional Name: diethyl-[4-[[2-[4-(4-methoxyphenyl)piperazino]pyrimidin-4-yl]amino]-2,5-dimethyl-phenyl]amine Formula: C27H36N6O MolecularWeight: 460.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1C)NC2=NC(=NC=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1C)NC2=NC(=NC=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)C

InChI

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