N2-(4-ethylphenyl)-6-[(4-ethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-ethylphenyl)-6-[(4-ethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(4-ethylphenyl)-6-[(4-ethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-ethylphenyl)-6-[(4-ethyl-1-piperazinyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-ethylphenyl)-6-[(4-ethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-ethylpiperazino)methyl]-s-triazin-2-yl]-(4-ethylphenyl)amine Formula: C18H27N7 MolecularWeight: 341.45388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC

InChI

InChI=1S/C18H27N7/c1-3-14-5-7-15(8-6-14)20-18-22-16(21-17(19)23-18)13-25-11-9-24(4-2)10-12-25/h5-8H,3-4,9-13H2,1-2H3,(H3,19,20,21,22,23)