N3,N3-bis(1,2,4-triazol-1-ylmethyl)pentane-1,3,5-triamine

Systemtic Name: N3,N3-bis(1,2,4-triazol-1-ylmethyl)pentane-1,3,5-triamine Openeye Name: N3,N3-bis(1,2,4-triazol-1-ylmethyl)pentane-1,3,5-triamine CAS Name: N3,N3-bis(1,2,4-triazol-1-ylmethyl)pentane-1,3,5-triamine IUPAC Name: 3-N,3-N-bis(1,2,4-triazol-1-ylmethyl)pentane-1,3,5-triamine Traditional Name: [3-amino-1-(2-aminoethyl)propyl]-bis(1,2,4-triazol-1-ylmethyl)amine Formula: C11H21N9 MolecularWeight: 279.34474

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)CN(CN2C=NC=N2)C(CCN)CCN

Isomeric SMILES

C1=NN(C=N1)CN(CN2C=NC=N2)C(CCN)CCN

InChI

InChI=1S/C11H21N9/c12-3-1-11(2-4-13)18(9-19-7-14-5-16-19)10-20-8-15-6-17-20/h5-8,11H,1-4,9-10,12-13H2