(2E)-2-(5-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-methyl-5-(1-methylpyrrol-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-(1-methylpyrrol-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-(1-methylpyrrol-2-yl)-3-phenethyl-1H-pyrimidin-4-one CAS Name: (2E)-2-(5-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)-6-methyl-5-(1-methyl-2-pyrrolyl)-3-phenethyl-1H-pyrimidin-4-one IUPAC Name: (2E)-2-(5-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-methyl-5-(1-methylpyrrol-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-(1-methylpyrrol-2-yl)-3-phenethyl-1H-pyrimidin-4-one Formula: C24H22FN3O2 MolecularWeight: 403.448783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=C2C=CC=C(C2=O)F)N1)CCC3=CC=CC=C3)C4=CC=CN4C

Isomeric SMILES

CC1=C(C(=O)N(/C(=C/2\C=CC=C(C2=O)F)/N1)CCC3=CC=CC=C3)C4=CC=CN4C

InChI

InChI=1S/C24H22FN3O2/c1-16-21(20-12-7-14-27(20)2)24(30)28(15-13-17-8-4-3-5-9-17)23(26-16)18-10-6-11-19(25)22(18)29/h3-12,14,26H,13,15H2,1-2H3/b23-18+