5-[[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenyl]methylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenyl]methylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylamino]benzene-1,3-dicarboxamide CAS Name: 5-[[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylamino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylamino]benzene-1,3-dicarboxamide Traditional Name: 5-[[3-(4,6-diamino-2,2-dimethyl-s-triazin-1-yl)benzyl]amino]isophthalamide Formula: C20H24N8O2 MolecularWeight: 408.45696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC=CC(=C2)CNC3=CC(=CC(=C3)C(=O)N)C(=O)N)N)N)C

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC=CC(=C2)CNC3=CC(=CC(=C3)C(=O)N)C(=O)N)N)N)C

InChI

InChI=1S/C20H24N8O2/c1-20(2)27-18(23)26-19(24)28(20)15-5-3-4-11(6-15)10-25-14-8-12(16(21)29)7-13(9-14)17(22)30/h3-9,25H,10H2,1-2H3,(H2,21,29)(H2,22,30)(H4,23,24,26,27)