6-chloranyl-4-phenyl-N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)quinazolin-2-amine

Systemtic Name: 6-chloranyl-4-phenyl-N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)quinazolin-2-amine Openeye Name: 6-chloro-N-(3-isopropyl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)-4-phenyl-quinazolin-2-amine CAS Name: 6-chloro-4-phenyl-N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)-2-quinazolinamine IUPAC Name: 6-chloro-4-phenyl-N-(3-propan-2-yl-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl)quinazolin-2-amine Traditional Name: (6-chloro-4-phenyl-quinazolin-2-yl)-(3-isopropyl-1,2,3,4-tetrahydro-s-triazine-3,5-diium-6-yl)amine Formula: C20H23ClN6+2 MolecularWeight: 382.88982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CNC(=[NH+]C1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)[NH+]1CNC(=[NH+]C1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN6/c1-13(2)27-11-22-19(23-12-27)26-20-24-17-9-8-15(21)10-16(17)18(25-20)14-6-4-3-5-7-14/h3-10,13H,11-12H2,1-2H3,(H2,22,23,24,25,26)/p+2