2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-5-(4-methylphenyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-5-(4-methylphenyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]sulfanyl-6-methyl-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-[1-(3-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]thio]-6-methyl-5-(4-methylphenyl)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-6-methyl-5-(4-methylphenyl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]thio]-6-methyl-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C34H28FN3O2S2 MolecularWeight: 593.733423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C(=N3)SCC(=O)C4=C(N(C(=C4)C)C5=CC(=CC=C5)F)C)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C(=N3)SCC(=O)C4=C(N(C(=C4)C)C5=CC(=CC=C5)F)C)C6=CC=CC=C6)C

InChI

InChI=1S/C34H28FN3O2S2/c1-20-13-15-24(16-14-20)30-23(4)42-32-31(30)33(40)38(26-10-6-5-7-11-26)34(36-32)41-19-29(39)28-17-21(2)37(22(28)3)27-12-8-9-25(35)18-27/h5-18H,19H2,1-4H3