3-[[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)amino]methyl]benzamide

Systemtic Name: 3-[[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)amino]methyl]benzamide Openeye Name: 3-[[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)amino]methyl]benzamide CAS Name: 3-[[[4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-5-ium-2-yl]amino]methyl]benzamide IUPAC Name: 3-[[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)amino]methyl]benzamide Traditional Name: 3-[[(4,6-dipyrrolidino-s-triazin-5-ium-2-yl)amino]methyl]benzamide Formula: C19H26N7O+ MolecularWeight: 368.45604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C(=NC(=N2)NCC3=CC=CC(=C3)C(=O)N)N4CCCC4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C(=NC(=N2)NCC3=CC=CC(=C3)C(=O)N)N4CCCC4

InChI

InChI=1S/C19H25N7O/c20-16(27)15-7-5-6-14(12-15)13-21-17-22-18(25-8-1-2-9-25)24-19(23-17)26-10-3-4-11-26/h5-7,12H,1-4,8-11,13H2,(H2,20,27)(H,21,22,23,24)/p+1