4-[2-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]ethyl]-2-methoxy-phenol

Systemtic Name: 4-[2-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]ethyl]-2-methoxy-phenol Openeye Name: 4-[2-[[4,6-bis(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]amino]ethyl]-2-methoxy-phenol CAS Name: 4-[2-[[4,6-bis(3,5-diamino-1-piperidinyl)-1,3,5-triazin-2-yl]amino]ethyl]-2-methoxyphenol IUPAC Name: 4-[2-[[4,6-bis(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]amino]ethyl]-2-methoxyphenol Traditional Name: 4-[2-[[4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]amino]ethyl]-2-methoxy-phenol Formula: C22H36N10O2 MolecularWeight: 472.58704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC2=NC(=NC(=N2)N3CC(CC(C3)N)N)N4CC(CC(C4)N)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC2=NC(=NC(=N2)N3CC(CC(C3)N)N)N4CC(CC(C4)N)N)O

InChI

InChI=1S/C22H36N10O2/c1-34-19-6-13(2-3-18(19)33)4-5-27-20-28-21(31-9-14(23)7-15(24)10-31)30-22(29-20)32-11-16(25)8-17(26)12-32/h2-3,6,14-17,33H,4-5,7-12,23-26H2,1H3,(H,27,28,29,30)