6-chloranyl-4-phenyl-N-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)quinazolin-2-amine

Systemtic Name: 6-chloranyl-4-phenyl-N-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)quinazolin-2-amine Openeye Name: 6-chloro-4-phenyl-N-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)quinazolin-2-amine CAS Name: 6-chloro-4-phenyl-N-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)-2-quinazolinamine IUPAC Name: 6-chloro-4-phenyl-N-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)quinazolin-2-amine Traditional Name: (6-chloro-4-phenyl-quinazolin-2-yl)-(4,4,6-trimethyl-1H-pyrimidin-3-ium-2-yl)amine Formula: C21H21ClN5+ MolecularWeight: 378.87794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC([NH+]=C(N1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)(C)C

Isomeric SMILES

CC1=CC([NH+]=C(N1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)(C)C

InChI

InChI=1S/C21H20ClN5/c1-13-12-21(2,3)27-20(23-13)26-19-24-17-10-9-15(22)11-16(17)18(25-19)14-7-5-4-6-8-14/h4-12H,1-3H3,(H2,23,24,25,26,27)/p+1