1-[4-(benzimidazol-1-yl)-6-[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine

Systemtic Name: 1-[4-(benzimidazol-1-yl)-6-[3,5-bis(azanyl)piperidin-1-yl]-1,3,5-triazin-2-yl]piperidine-3,5-diamine Openeye Name: 1-[4-(benzimidazol-1-yl)-6-(3,5-diamino-1-piperidyl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine CAS Name: 1-[4-(1-benzimidazolyl)-6-(3,5-diamino-1-piperidinyl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine IUPAC Name: 1-[4-(benzimidazol-1-yl)-6-(3,5-diaminopiperidin-1-yl)-1,3,5-triazin-2-yl]piperidine-3,5-diamine Traditional Name: [5-amino-1-[4-(benzimidazol-1-yl)-6-(3,5-diaminopiperidino)-s-triazin-2-yl]-3-piperidyl]amine Formula: C20H29N11 MolecularWeight: 423.51796

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1N)C2=NC(=NC(=N2)N3C=NC4=CC=CC=C43)N5CC(CC(C5)N)N)N

Isomeric SMILES

C1C(CN(CC1N)C2=NC(=NC(=N2)N3C=NC4=CC=CC=C43)N5CC(CC(C5)N)N)N

InChI

InChI=1S/C20H29N11/c21-12-5-13(22)8-29(7-12)18-26-19(30-9-14(23)6-15(24)10-30)28-20(27-18)31-11-25-16-3-1-2-4-17(16)31/h1-4,11-15H,5-10,21-24H2