4-[[4-(4-ethoxyphenoxy)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[4-(4-ethoxyphenoxy)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-(4-ethoxyphenoxy)-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-(4-ethoxyphenoxy)-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-(4-ethoxyphenoxy)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-(4-ethoxyphenoxy)-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]methyl]morpholin-4-ium Formula: C23H24N3O3S2+ MolecularWeight: 454.58496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C3C(=CSC3=NC(=N2)C[NH+]4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C23H23N3O3S2/c1-2-28-16-5-7-17(8-6-16)29-22-21-18(19-4-3-13-30-19)15-31-23(21)25-20(24-22)14-26-9-11-27-12-10-26/h3-8,13,15H,2,9-12,14H2,1H3/p+1