3-ethyl-7-[[4-(2-fluorophenyl)carbonylphenyl]methyl]-5-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-7-[[4-(2-fluorophenyl)carbonylphenyl]methyl]-5-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-7-[[4-(2-fluorobenzoyl)phenyl]methyl]-5-methyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-7-[[4-[(2-fluorophenyl)-oxomethyl]phenyl]methyl]-5-methyl-2-(methylthio)-4-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-7-[[4-(2-fluorobenzoyl)phenyl]methyl]-5-methyl-2-methylsulfanylpyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-7-[4-(2-fluorobenzoyl)benzyl]-5-methyl-2-(methylthio)pyrrolo[2,3-d]pyrimidin-4-one Formula: C24H22FN3O2S MolecularWeight: 435.513783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC)N(C=C2C)CC3=CC=C(C=C3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC)N(C=C2C)CC3=CC=C(C=C3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C24H22FN3O2S/c1-4-28-23(30)20-15(2)13-27(22(20)26-24(28)31-3)14-16-9-11-17(12-10-16)21(29)18-7-5-6-8-19(18)25/h5-13H,4,14H2,1-3H3