[5-(4-bromophenyl)furan-2-yl]methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: [5-(4-bromophenyl)furan-2-yl]methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: [5-(4-bromophenyl)-2-furyl]methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: [5-(4-bromophenyl)-2-furanyl]methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: [5-(4-bromophenyl)furan-2-yl]methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [5-(4-bromophenyl)-2-furyl]methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C21H19BrN3O2+ MolecularWeight: 425.29846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(O1)C2=CC=C(C=C2)Br)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[NH+](CC1=CC=C(O1)C2=CC=C(C=C2)Br)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H18BrN3O2/c1-25(13-20-23-18-5-3-2-4-17(18)21(26)24-20)12-16-10-11-19(27-16)14-6-8-15(22)9-7-14/h2-11H,12-13H2,1H3,(H,23,24,26)/p+1