4-[[4-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[4-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-[(2-phenyloxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-[(2-phenyl-4-oxazolyl)methylthio]-2-quinazolinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-[(2-phenyloxazol-4-yl)methylthio]quinazolin-2-yl]methyl]morpholin-4-ium Formula: C23H23N4O2S+ MolecularWeight: 419.51932

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)SCC4=COC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)SCC4=COC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C23H22N4O2S/c1-2-6-17(7-3-1)22-24-18(15-29-22)16-30-23-19-8-4-5-9-20(19)25-21(26-23)14-27-10-12-28-13-11-27/h1-9,15H,10-14,16H2/p+1