4-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-fluoranyl-2-oxidanyl-N-phenyl-benzamide

Systemtic Name: 4-[[4,6-bis[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-fluoranyl-2-oxidanyl-N-phenyl-benzamide Openeye Name: 4-[[4,6-bis(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]amino]-N-fluoro-2-hydroxy-N-phenyl-benzamide CAS Name: 4-[[4,6-bis(3,5-diamino-1-piperidinyl)-1,3,5-triazin-2-yl]amino]-N-fluoro-2-hydroxy-N-phenylbenzamide IUPAC Name: 4-[[4,6-bis(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]amino]-N-fluoro-2-hydroxy-N-phenylbenzamide Traditional Name: 4-[[4,6-bis(3,5-diaminopiperidino)-s-triazin-2-yl]amino]-N-fluoro-2-hydroxy-N-phenyl-benzamide Formula: C26H34FN11O2 MolecularWeight: 551.619063

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C(=O)N(C4=CC=CC=C4)F)O)N5CC(CC(C5)N)N)N

Isomeric SMILES

C1C(CN(CC1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C(=O)N(C4=CC=CC=C4)F)O)N5CC(CC(C5)N)N)N

InChI

InChI=1S/C26H34FN11O2/c27-38(20-4-2-1-3-5-20)23(40)21-7-6-19(10-22(21)39)32-24-33-25(36-11-15(28)8-16(29)12-36)35-26(34-24)37-13-17(30)9-18(31)14-37/h1-7,10,15-18,39H,8-9,11-14,28-31H2,(H,32,33,34,35)