(3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine

Systemtic Name: (3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine Openeye Name: (3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-diamino-1-piperidyl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine CAS Name: (3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-diamino-1-piperidinyl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine IUPAC Name: (3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-diaminopiperidin-1-yl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine Traditional Name: [(3R,5S)-1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-6-[(3R,5S)-3,5-diaminopiperidino]-s-triazin-2-yl]-5-amino-3-piperidyl]amine Formula: C22H40N10 MolecularWeight: 444.62

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CCCN2C3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N

Isomeric SMILES

C1CCC2C(C1)CCCN2C3=NC(=NC(=N3)N4C[C@@H](C[C@@H](C4)N)N)N5C[C@@H](C[C@@H](C5)N)N

InChI

InChI=1S/C22H40N10/c23-15-8-16(24)11-30(10-15)20-27-21(31-12-17(25)9-18(26)13-31)29-22(28-20)32-7-3-5-14-4-1-2-6-19(14)32/h14-19H,1-13,23-26H2/t14?,15-,16+,17-,18+,19?