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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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