2-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-ethyl-propane-1,3-diol

Systemtic Name: 2-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-ethyl-propane-1,3-diol Openeye Name: 2-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-ethyl-propane-1,3-diol CAS Name: 2-[[4,6-bis(1-aziridinyl)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol IUPAC Name: 2-[[4,6-bis(aziridin-1-yl)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol Traditional Name: 2-[(4,6-diethylenimino-s-triazin-2-yl)amino]-2-ethyl-propane-1,3-diol Formula: C12H20N6O2 MolecularWeight: 280.3262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)NC1=NC(=NC(=N1)N2CC2)N3CC3

Isomeric SMILES

CCC(CO)(CO)NC1=NC(=NC(=N1)N2CC2)N3CC3

InChI

InChI=1S/C12H20N6O2/c1-2-12(7-19,8-20)16-9-13-10(17-3-4-17)15-11(14-9)18-5-6-18/h19-20H,2-8H2,1H3,(H,13,14,15,16)