2-[2-[1-[2,5-bis(fluoranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-5-(4-chlorophenyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-[1-[2,5-bis(fluoranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]sulfanyl-5-(4-chlorophenyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-chlorophenyl)-2-[2-[1-(2,5-difluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-chlorophenyl)-2-[[2-[1-(2,5-difluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]thio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-chlorophenyl)-2-[2-[1-(2,5-difluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-chlorophenyl)-2-[[2-[1-(2,5-difluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]thio]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C32H22ClF2N3O2S2 MolecularWeight: 618.115786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=CC(=C2)F)F)C)C(=O)CSC3=NC4=C(C(=CS4)C5=CC=C(C=C5)Cl)C(=O)N3C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)F)F)C)C(=O)CSC3=NC4=C(C(=CS4)C5=CC=C(C=C5)Cl)C(=O)N3C6=CC=CC=C6

InChI

InChI=1S/C32H22ClF2N3O2S2/c1-18-14-24(19(2)37(18)27-15-22(34)12-13-26(27)35)28(39)17-42-32-36-30-29(31(40)38(32)23-6-4-3-5-7-23)25(16-41-30)20-8-10-21(33)11-9-20/h3-16H,17H2,1-2H3