2-[2-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[2-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[2-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]sulfanyl-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]thio]-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[2-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[2-[3,5-bis(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-keto-ethyl]thio]-3-(4-fluorophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C31H27FN4O4S2 MolecularWeight: 602.698883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)F)SCC4)C6=CC=C(C=C6)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)F)SCC4)C6=CC=C(C=C6)OC

InChI

InChI=1S/C31H27FN4O4S2/c1-39-23-11-3-19(4-12-23)26-17-27(20-5-13-24(40-2)14-6-20)36(34-26)28(37)18-42-31-33-25-15-16-41-29(25)30(38)35(31)22-9-7-21(32)8-10-22/h3-14,27H,15-18H2,1-2H3