N2-(5-chloranyl-2-methoxy-phenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(5-chloranyl-2-methoxy-phenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(5-chloro-2-methoxy-phenyl)-6-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(5-chloro-2-methoxyphenyl)-6-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(5-chloro-2-methoxyphenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[4-(2-pyridyl)piperazino]methyl]-s-triazin-2-yl]-(5-chloro-2-methoxy-phenyl)amine Formula: C20H23ClN8O MolecularWeight: 426.90262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC2=NC(=NC(=N2)N)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC2=NC(=NC(=N2)N)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H23ClN8O/c1-30-16-6-5-14(21)12-15(16)24-20-26-17(25-19(22)27-20)13-28-8-10-29(11-9-28)18-4-2-3-7-23-18/h2-7,12H,8-11,13H2,1H3,(H3,22,24,25,26,27)