(5-bromanylthiophen-2-yl)methyl-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C16H17BrN3OS+ MolecularWeight: 379.29468

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(S1)Br)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC[NH+](CC1=CC=C(S1)Br)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H16BrN3OS/c1-2-20(9-11-7-8-14(17)22-11)10-15-18-13-6-4-3-5-12(13)16(21)19-15/h3-8H,2,9-10H2,1H3,(H,18,19,21)/p+1