4-[[4-[2-(4-methoxyphenoxy)ethylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[4-[2-(4-methoxyphenoxy)ethylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-[2-(4-methoxyphenoxy)ethylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-[2-(4-methoxyphenoxy)ethylthio]-2-quinazolinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-[2-(4-methoxyphenoxy)ethylsulfanyl]quinazolin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-[2-(4-methoxyphenoxy)ethylthio]quinazolin-2-yl]methyl]morpholin-4-ium Formula: C22H26N3O3S+ MolecularWeight: 412.52514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCSC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)OCCSC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C22H25N3O3S/c1-26-17-6-8-18(9-7-17)28-14-15-29-22-19-4-2-3-5-20(19)23-21(24-22)16-25-10-12-27-13-11-25/h2-9H,10-16H2,1H3/p+1