6-[(1S)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(1S)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(1S)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[(1S)-1-[(3S)-3-methyl-1-piperidin-1-iumyl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(1S)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(1S)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-s-triazin-2-yl]-phenyl-amine Formula: C17H25N6+ MolecularWeight: 313.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C17H24N6/c1-12-7-6-10-23(11-12)13(2)15-20-16(18)22-17(21-15)19-14-8-4-3-5-9-14/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3,(H3,18,19,20,21,22)/p+1/t12-,13-/m0/s1