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

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-3-(2-fluorophenyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-(2-diethylaminoethylsulfanyl)-3-(2-fluorophenyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(2-diethylaminoethylthio)-3-(2-fluorophenyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-(2-diethylaminoethylsulfanyl)-3-(2-fluorophenyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-(2-diethylaminoethylthio)-3-(2-fluorophenyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C22H23FN4OS MolecularWeight: 410.507623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC2=C(C(=O)N1C3=CC=CC=C3F)NC4=CC=CC=C42

Isomeric SMILES

CCN(CC)CCSC1=NC2=C(C(=O)N1C3=CC=CC=C3F)NC4=CC=CC=C42

InChI

InChI=1S/C22H23FN4OS/c1-3-26(4-2)13-14-29-22-25-19-15-9-5-7-11-17(15)24-20(19)21(28)27(22)18-12-8-6-10-16(18)23/h5-12,24H,3-4,13-14H2,1-2H3