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

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-3-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C18H14FN3OS MolecularWeight: 339.386663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC4=CC(=CC=C4)F

Isomeric SMILES

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC4=CC(=CC=C4)F

InChI

InChI=1S/C18H14FN3OS/c1-22-17(23)16-15(13-7-2-3-8-14(13)20-16)21-18(22)24-10-11-5-4-6-12(19)9-11/h2-9,20H,10H2,1H3