5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(5-fluoro-2-methyl-4-pyrrolidino-benzylidene)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C28H24FN3O2S MolecularWeight: 485.572463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)F)N5CCCC5

Isomeric SMILES

CC1=CC(=C(C=C1C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)F)N5CCCC5

InChI

InChI=1S/C28H24FN3O2S/c1-19-16-25(30-14-8-9-15-30)24(29)18-20(19)17-23-26(33)31(21-10-4-2-5-11-21)28(35)32(27(23)34)22-12-6-3-7-13-22/h2-7,10-13,16-18H,8-9,14-15H2,1H3