3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(1,3-benzothiazol-2-ylmethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H12FN3OS2 MolecularWeight: 393.457183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C20H12FN3OS2/c21-13-7-5-12(6-8-13)14-10-26-19-18(14)20(25)24(11-22-19)9-17-23-15-3-1-2-4-16(15)27-17/h1-8,10-11H,9H2