1-[3-(morpholin-4-ium-4-ylmethyl)-4-thieno[2,3-d]pyrimidin-4-yloxy-phenyl]ethanone

Systemtic Name: 1-[3-(morpholin-4-ium-4-ylmethyl)-4-thieno[2,3-d]pyrimidin-4-yloxy-phenyl]ethanone Openeye Name: 1-[3-(morpholin-4-ium-4-ylmethyl)-4-thieno[2,3-d]pyrimidin-4-yloxy-phenyl]ethanone CAS Name: 1-[3-(4-morpholin-4-iumylmethyl)-4-(4-thieno[2,3-d]pyrimidinyloxy)phenyl]ethanone IUPAC Name: 1-[3-(morpholin-4-ium-4-ylmethyl)-4-thieno[2,3-d]pyrimidin-4-yloxyphenyl]ethanone Traditional Name: 1-[3-(morpholin-4-ium-4-ylmethyl)-4-thieno[2,3-d]pyrimidin-4-yloxy-phenyl]ethanone Formula: C19H20N3O3S+ MolecularWeight: 370.4454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S/c1-13(23)14-2-3-17(15(10-14)11-22-5-7-24-8-6-22)25-18-16-4-9-26-19(16)21-12-20-18/h2-4,9-10,12H,5-8,11H2,1H3/p+1