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

Systemtic Name: 4-[[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-[[2-(2-thienyl)oxazol-4-yl]methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-[(2-thiophen-2-yl-4-oxazolyl)methylthio]-2-quinazolinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-[[2-(2-thienyl)oxazol-4-yl]methylthio]quinazolin-2-yl]methyl]morpholin-4-ium Formula: C21H21N4O2S2+ MolecularWeight: 425.54704

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)SCC4=COC(=N4)C5=CC=CS5

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)SCC4=COC(=N4)C5=CC=CS5

InChI

InChI=1S/C21H20N4O2S2/c1-2-5-17-16(4-1)21(24-19(23-17)12-25-7-9-26-10-8-25)29-14-15-13-27-20(22-15)18-6-3-11-28-18/h1-6,11,13H,7-10,12,14H2/p+1