3-(2-fluorophenyl)-2-(2-hydroxyethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(2-fluorophenyl)-2-(2-hydroxyethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(2-fluorophenyl)-2-(2-hydroxyethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(2-fluorophenyl)-2-(2-hydroxyethylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(2-fluorophenyl)-2-(2-hydroxyethylsulfanyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(2-fluorophenyl)-2-(2-hydroxyethylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C18H14FN3O2S MolecularWeight: 355.386063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C(=N3)SCCO)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C(=N3)SCCO)C4=CC=CC=C4F

InChI

InChI=1S/C18H14FN3O2S/c19-12-6-2-4-8-14(12)22-17(24)16-15(21-18(22)25-10-9-23)11-5-1-3-7-13(11)20-16/h1-8,20,23H,9-10H2