5-(4-methoxyphenyl)-4-(2-methylquinolin-8-yl)oxy-thieno[2,3-d]pyrimidin-1-ium

Systemtic Name: 5-(4-methoxyphenyl)-4-(2-methylquinolin-8-yl)oxy-thieno[2,3-d]pyrimidin-1-ium Openeye Name: 5-(4-methoxyphenyl)-4-[(2-methyl-8-quinolyl)oxy]thieno[2,3-d]pyrimidin-1-ium CAS Name: 5-(4-methoxyphenyl)-4-[(2-methyl-8-quinolinyl)oxy]thieno[2,3-d]pyrimidin-1-ium IUPAC Name: 5-(4-methoxyphenyl)-4-(2-methylquinolin-8-yl)oxythieno[2,3-d]pyrimidin-1-ium Traditional Name: 5-(4-methoxyphenyl)-4-[(2-methyl-8-quinolyl)oxy]thieno[2,3-d]pyrimidin-1-ium Formula: C23H18N3O2S+ MolecularWeight: 400.47292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=C4C(=CSC4=[NH+]C=N3)C5=CC=C(C=C5)OC)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=C4C(=CSC4=[NH+]C=N3)C5=CC=C(C=C5)OC)C=C1

InChI

InChI=1S/C23H17N3O2S/c1-14-6-7-16-4-3-5-19(21(16)26-14)28-22-20-18(12-29-23(20)25-13-24-22)15-8-10-17(27-2)11-9-15/h3-13H,1-2H3/p+1