6-chloranyl-N-(4,4-dimethyl-6-methylidene-1,5-dihydropyrimidin-3-ium-2-yl)-4-phenyl-quinazolin-2-amine

Systemtic Name: 6-chloranyl-N-(4,4-dimethyl-6-methylidene-1,5-dihydropyrimidin-3-ium-2-yl)-4-phenyl-quinazolin-2-amine Openeye Name: 6-chloro-N-(4,4-dimethyl-6-methylene-1,5-dihydropyrimidin-3-ium-2-yl)-4-phenyl-quinazolin-2-amine CAS Name: 6-chloro-N-(4,4-dimethyl-6-methylene-1,5-dihydropyrimidin-3-ium-2-yl)-4-phenyl-2-quinazolinamine IUPAC Name: 6-chloro-N-(4,4-dimethyl-6-methylidene-1,5-dihydropyrimidin-3-ium-2-yl)-4-phenylquinazolin-2-amine Traditional Name: (6-chloro-4-phenyl-quinazolin-2-yl)-(4,4-dimethyl-6-methylene-1,5-dihydropyrimidin-3-ium-2-yl)amine Formula: C21H21ClN5+ MolecularWeight: 378.87794

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C)NC(=[NH+]1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=C)NC(=[NH+]1)NC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)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/h4-11H,1,12H2,2-3H3,(H2,23,24,25,26,27)/p+1