N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-pyridin-3-yl-quinazolin-4-amine

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-pyridin-3-yl-quinazolin-4-amine Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(3-pyridyl)quinazolin-4-amine CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-2-(3-pyridinyl)-4-quinazolinamine IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-pyridin-3-ylquinazolin-4-amine Traditional Name: (1-morpholin-4-ium-4-ylcyclohexyl)methyl-[2-(3-pyridyl)quinazolin-4-yl]amine Formula: C24H30N5O+ MolecularWeight: 404.5279

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)[NH+]5CCOCC5

Isomeric SMILES

C1CCC(CC1)(CNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4)[NH+]5CCOCC5

InChI

InChI=1S/C24H29N5O/c1-4-10-24(11-5-1,29-13-15-30-16-14-29)18-26-23-20-8-2-3-9-21(20)27-22(28-23)19-7-6-12-25-17-19/h2-3,6-9,12,17H,1,4-5,10-11,13-16,18H2,(H,26,27,28)/p+1