3-(2-fluorophenyl)-2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2-fluorophenyl)-2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-fluorophenyl)-2-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-fluorophenyl)-2-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-(2-fluorophenyl)-2-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-fluorophenyl)-2-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C26H20FN3O2S2 MolecularWeight: 489.584303

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4F)SCC(=O)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4F)SCC(=O)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C26H20FN3O2S2/c27-18-9-3-5-11-20(18)30-25(32)23-16-8-2-6-12-22(16)34-24(23)29-26(30)33-14-21(31)17-13-28-19-10-4-1-7-15(17)19/h1,3-5,7,9-11,13,28H,2,6,8,12,14H2