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

Systemtic Name: 4-[[4,6-bis[(3S,5R)-3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2-chlorophenyl)-2-oxidanyl-benzamide Openeye Name: 4-[[4,6-bis[(3S,5R)-3,5-diamino-1-piperidyl]-1,3,5-triazin-2-yl]amino]-N-(2-chlorophenyl)-2-hydroxy-benzamide CAS Name: 4-[[4,6-bis[(3S,5R)-3,5-diamino-1-piperidinyl]-1,3,5-triazin-2-yl]amino]-N-(2-chlorophenyl)-2-hydroxybenzamide IUPAC Name: 4-[[4,6-bis[(3S,5R)-3,5-diaminopiperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2-chlorophenyl)-2-hydroxybenzamide Traditional Name: 4-[[4,6-bis[(3S,5R)-3,5-diaminopiperidino]-s-triazin-2-yl]amino]-N-(2-chlorophenyl)-2-hydroxy-benzamide Formula: C26H34ClN11O2 MolecularWeight: 568.07366

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C(=O)NC4=CC=CC=C4Cl)O)N5CC(CC(C5)N)N)N

Isomeric SMILES

C1[C@H](CN(C[C@H]1N)C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C(=O)NC4=CC=CC=C4Cl)O)N5C[C@@H](C[C@@H](C5)N)N)N

InChI

InChI=1S/C26H34ClN11O2/c27-20-3-1-2-4-21(20)33-23(40)19-6-5-18(9-22(19)39)32-24-34-25(37-10-14(28)7-15(29)11-37)36-26(35-24)38-12-16(30)8-17(31)13-38/h1-6,9,14-17,39H,7-8,10-13,28-31H2,(H,33,40)(H,32,34,35,36)/t14-,15+,16-,17+