3-[[4-(2-azanylethylamino)-6-[(3S,5R)-3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]fluoren-9-one

Systemtic Name: 3-[[4-(2-azanylethylamino)-6-[(3S,5R)-3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]fluoren-9-one Openeye Name: 3-[[4-(2-aminoethylamino)-6-[(3S,5R)-3,5-diamino-1-piperidyl]-1,3,5-triazin-2-yl]amino]fluoren-9-one CAS Name: 3-[[4-(2-aminoethylamino)-6-[(3S,5R)-3,5-diamino-1-piperidinyl]-1,3,5-triazin-2-yl]amino]-9-fluorenone IUPAC Name: 3-[[4-(2-aminoethylamino)-6-[(3S,5R)-3,5-diaminopiperidin-1-yl]-1,3,5-triazin-2-yl]amino]fluoren-9-one Traditional Name: 3-[[4-(2-aminoethylamino)-6-[(3S,5R)-3,5-diaminopiperidino]-s-triazin-2-yl]amino]fluoren-9-one Formula: C23H27N9O MolecularWeight: 445.52018

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)NCCN)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C54)N

Isomeric SMILES

C1[C@H](CN(C[C@H]1N)C2=NC(=NC(=N2)NCCN)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C54)N

InChI

InChI=1S/C23H27N9O/c24-7-8-27-21-29-22(31-23(30-21)32-11-13(25)9-14(26)12-32)28-15-5-6-18-19(10-15)16-3-1-2-4-17(16)20(18)33/h1-6,10,13-14H,7-9,11-12,24-26H2,(H2,27,28,29,30,31)/t13-,14+