ETHYL 3-(3-[(1-(4-FLUOROPHENYL)-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE

CAS No.
CCD No.
CCD00408912
Formula
C26 H22 F N3 O4 S
MolWeight
491.541

Basic Information

Product Name: ETHYL 3-(3-[(1-(4-FLUOROPHENYL)-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE
English Synonyms: ETHYL 3-(3-[(1-(4-FLUOROPHENYL)-4,6-DIOXO-2-THIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE
MDL Number.: MFCD03705997
H bond acceptor: 7
H bond donor: 1
Smile: CCOC(=O)c1cccc(c1)n2c(cc(c2C)/C=C\3/C(=O)NC(=S)N(C3=O)c4ccc(cc4)F)C
InChi: InChI=1S/C26H22FN3O4S/c1-4-34-25(33)17-6-5-7-21(13-17)29-15(2)12-18(16(29)3)14-22-23(31)28-26(35)30(24(22)32)20-10-8-19(27)9-11-20/h5-14H,4H2,1-3H3,(H,28,31,35)/b22-14-
InChiKey: InChIKey=LASHJLAEPGERTO-HMAPJEAMSA-N

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