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

Systemtic Name: N2-(2-ethylphenyl)-6-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-ethylphenyl)-6-[[(3S)-3-methyl-1-piperidyl]methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-ethylphenyl)-6-[[(3S)-3-methyl-1-piperidinyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-ethylphenyl)-6-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(3S)-3-methylpiperidino]methyl]-s-triazin-2-yl]-(2-ethylphenyl)amine Formula: C18H26N6 MolecularWeight: 326.43924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3CCCC(C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3CCC[C@@H](C3)C

InChI

InChI=1S/C18H26N6/c1-3-14-8-4-5-9-15(14)20-18-22-16(21-17(19)23-18)12-24-10-6-7-13(2)11-24/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H3,19,20,21,22,23)/t13-/m0/s1