(2E)-2-(5-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-methyl-5-(4-methyl-5-pyridin-2-yl-thiophen-2-yl)-3-phenethyl-1H-pyrimidin-4-one

Systemtic Name: (2E)-2-(5-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-methyl-5-(4-methyl-5-pyridin-2-yl-thiophen-2-yl)-3-phenethyl-1H-pyrimidin-4-one Openeye Name: (2E)-2-(5-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-6-methyl-5-[4-methyl-5-(2-pyridyl)-2-thienyl]-3-phenethyl-1H-pyrimidin-4-one CAS Name: (2E)-2-(5-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)-6-methyl-5-[4-methyl-5-(2-pyridinyl)-2-thiophenyl]-3-phenethyl-1H-pyrimidin-4-one IUPAC Name: (2E)-2-(5-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-methyl-5-(4-methyl-5-pyridin-2-ylthiophen-2-yl)-3-phenethyl-1H-pyrimidin-4-one Traditional Name: (2E)-2-(5-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)-6-methyl-5-[4-methyl-5-(2-pyridyl)-2-thienyl]-3-phenethyl-1H-pyrimidin-4-one Formula: C29H24FN3O2S MolecularWeight: 497.583163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=C(NC(=C3C=CC=C(C3=O)F)N(C2=O)CCC4=CC=CC=C4)C)C5=CC=CC=N5

Isomeric SMILES

CC1=C(SC(=C1)C2=C(N/C(=C\3/C=CC=C(C3=O)F)/N(C2=O)CCC4=CC=CC=C4)C)C5=CC=CC=N5

InChI

InChI=1S/C29H24FN3O2S/c1-18-17-24(36-27(18)23-13-6-7-15-31-23)25-19(2)32-28(21-11-8-12-22(30)26(21)34)33(29(25)35)16-14-20-9-4-3-5-10-20/h3-13,15,17,32H,14,16H2,1-2H3/b28-21+