2-[[3-(4-bromophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[1-(4-fluorophenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[[3-(4-bromophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[1-(4-fluorophenyl)ethylideneamino]ethanamide Openeye Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[1-(4-fluorophenyl)ethylideneamino]acetamide CAS Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-N-[1-(4-fluorophenyl)ethylideneamino]acetamide IUPAC Name: 2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[1-(4-fluorophenyl)ethylideneamino]acetamide Traditional Name: 2-[[3-(4-bromophenyl)-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]thio]-N-[1-(4-fluorophenyl)ethylideneamino]acetamide Formula: C26H22BrFN4O2S2 MolecularWeight: 585.510883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)Br)C5=CC=C(C=C5)F

Isomeric SMILES

CC(=NNC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)Br)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22BrFN4O2S2/c1-15(16-6-10-18(28)11-7-16)30-31-22(33)14-35-26-29-24-23(20-4-2-3-5-21(20)36-24)25(34)32(26)19-12-8-17(27)9-13-19/h6-13H,2-5,14H2,1H3,(H,31,33)