3-[[4-(1-adamantylamino)-6-(3-methylbutylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol

Systemtic Name: 3-[[4-(1-adamantylamino)-6-(3-methylbutylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol Openeye Name: 3-[[4-(1-adamantylamino)-6-(isopentylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol CAS Name: 3-[[4-(1-adamantylamino)-6-(3-methylbutylamino)-1,3,5-triazin-2-yl]amino]-1-propanol IUPAC Name: 3-[[4-(1-adamantylamino)-6-(3-methylbutylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol Traditional Name: 3-[[4-(1-adamantylamino)-6-(isoamylamino)-s-triazin-2-yl]amino]propan-1-ol Formula: C21H36N6O MolecularWeight: 388.55014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=NC(=N1)NCCCO)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CCNC1=NC(=NC(=N1)NCCCO)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H36N6O/c1-14(2)4-6-23-19-24-18(22-5-3-7-28)25-20(26-19)27-21-11-15-8-16(12-21)10-17(9-15)13-21/h14-17,28H,3-13H2,1-2H3,(H3,22,23,24,25,26,27)