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

Systemtic Name: 4-[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl]oxybenzaldehyde Openeye Name: 4-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzaldehyde CAS Name: 4-[[2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl]oxy]benzaldehyde IUPAC Name: 4-[2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl]oxybenzaldehyde Traditional Name: 4-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzaldehyde Formula: C22H20N3O3S2+ MolecularWeight: 438.5425

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC(=C3C(=CSC3=N2)C4=CC=CS4)OC5=CC=C(C=C5)C=O

Isomeric SMILES

C1COCC[NH+]1CC2=NC(=C3C(=CSC3=N2)C4=CC=CS4)OC5=CC=C(C=C5)C=O

InChI

InChI=1S/C22H19N3O3S2/c26-13-15-3-5-16(6-4-15)28-21-20-17(18-2-1-11-29-18)14-30-22(20)24-19(23-21)12-25-7-9-27-10-8-25/h1-6,11,13-14H,7-10,12H2/p+1