2-[[4,6-bis[cyanomethyl(hydroxymethyl)amino]-1,3,5-triazin-2-yl]amino]ethanenitrile

Systemtic Name: 2-[[4,6-bis[cyanomethyl(hydroxymethyl)amino]-1,3,5-triazin-2-yl]amino]ethanenitrile Openeye Name: 2-[[4,6-bis[cyanomethyl(hydroxymethyl)amino]-1,3,5-triazin-2-yl]amino]acetonitrile CAS Name: 2-[[4,6-bis[cyanomethyl(hydroxymethyl)amino]-1,3,5-triazin-2-yl]amino]acetonitrile IUPAC Name: 2-[[4,6-bis[cyanomethyl(hydroxymethyl)amino]-1,3,5-triazin-2-yl]amino]acetonitrile Traditional Name: 2-[[4,6-bis[cyanomethyl(methylol)amino]-s-triazin-2-yl]amino]acetonitrile Formula: C11H13N9O2 MolecularWeight: 303.28002

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)NC1=NC(=NC(=N1)N(CC#N)CO)N(CC#N)CO

Isomeric SMILES

C(C#N)NC1=NC(=NC(=N1)N(CC#N)CO)N(CC#N)CO

InChI

InChI=1S/C11H13N9O2/c12-1-4-15-9-16-10(19(7-21)5-2-13)18-11(17-9)20(8-22)6-3-14/h21-22H,4-8H2,(H,15,16,17,18)