N-(3-cycloheptyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,7-dimethyl-quinazolin-2-amine

Systemtic Name: N-(3-cycloheptyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,7-dimethyl-quinazolin-2-amine Openeye Name: N-(3-cycloheptyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,7-dimethyl-quinazolin-2-amine CAS Name: N-(3-cycloheptyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,7-dimethyl-2-quinazolinamine IUPAC Name: N-(3-cycloheptyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,7-dimethylquinazolin-2-amine Traditional Name: (3-cycloheptyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)-(4,7-dimethylquinazolin-2-yl)amine Formula: C20H29N6+ MolecularWeight: 353.48446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)NC3=NC[NH+](CN3)C4CCCCCC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)NC3=NC[NH+](CN3)C4CCCCCC4)C

InChI

InChI=1S/C20H28N6/c1-14-9-10-17-15(2)23-20(24-18(17)11-14)25-19-21-12-26(13-22-19)16-7-5-3-4-6-8-16/h9-11,16H,3-8,12-13H2,1-2H3,(H2,21,22,23,24,25)/p+1