(3S,5R)-1-[4-[(3S,5R)-3,5-bis(azanyl)piperidin-1-yl]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine

Systemtic Name: (3S,5R)-1-[4-[(3S,5R)-3,5-bis(azanyl)piperidin-1-yl]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine Openeye Name: (3S,5R)-1-[4-[(3S,5R)-3,5-diamino-1-piperidyl]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine CAS Name: (3S,5R)-1-[4-[(3S,5R)-3,5-diamino-1-piperidinyl]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine IUPAC Name: (3S,5R)-1-[4-[(3S,5R)-3,5-diaminopiperidin-1-yl]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine Traditional Name: [(3S,5R)-5-amino-1-[4-[(3S,5R)-3,5-diaminopiperidino]-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-s-triazin-2-yl]-3-piperidyl]amine Formula: C20H36N10O2 MolecularWeight: 448.56564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C3=NC(=NC(=N3)N4CC(CC(C4)N)N)N5CC(CC(C5)N)N

Isomeric SMILES

C1CN(CCC12OCCO2)C3=NC(=NC(=N3)N4C[C@@H](C[C@@H](C4)N)N)N5C[C@@H](C[C@@H](C5)N)N

InChI

InChI=1S/C20H36N10O2/c21-13-7-14(22)10-29(9-13)18-25-17(28-3-1-20(2-4-28)31-5-6-32-20)26-19(27-18)30-11-15(23)8-16(24)12-30/h13-16H,1-12,21-24H2/t13-,14+,15-,16+