2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]azanium

Systemtic Name: 2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]azanium Openeye Name: 2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[[5-(2-thienyl)isoxazol-3-yl]methyl]ammonium CAS Name: 2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(5-thiophen-2-yl-3-isoxazolyl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]azanium Traditional Name: (4-keto-1H-quinazolin-2-yl)methyl-(2-methoxyethyl)-[[5-(2-thienyl)isoxazol-3-yl]methyl]ammonium Formula: C20H21N4O3S+ MolecularWeight: 397.47074

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=NOC(=C1)C2=CC=CS2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COCC[NH+](CC1=NOC(=C1)C2=CC=CS2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H20N4O3S/c1-26-9-8-24(12-14-11-17(27-23-14)18-7-4-10-28-18)13-19-21-16-6-3-2-5-15(16)20(25)22-19/h2-7,10-11H,8-9,12-13H2,1H3,(H,21,22,25)/p+1