7-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-phenyl-chromen-4-one

Systemtic Name: 7-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-phenyl-chromen-4-one Openeye Name: 7-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-phenyl-chromen-4-one CAS Name: 7-[[5,6-dimethyl-2-(4-morpholin-4-iumylmethyl)-4-thieno[2,3-d]pyrimidinyl]oxy]-3-phenyl-1-benzopyran-4-one IUPAC Name: 7-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-phenylchromen-4-one Traditional Name: 7-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxy-3-phenyl-chromone Formula: C28H26N3O4S+ MolecularWeight: 500.58874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)OC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=CC=C5)C[NH+]6CCOCC6)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)OC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=CC=C5)C[NH+]6CCOCC6)C

InChI

InChI=1S/C28H25N3O4S/c1-17-18(2)36-28-25(17)27(29-24(30-28)15-31-10-12-33-13-11-31)35-20-8-9-21-23(14-20)34-16-22(26(21)32)19-6-4-3-5-7-19/h3-9,14,16H,10-13,15H2,1-2H3/p+1