Vitas-M small molecule compound
methyl (2Z)-2-[1-(2-fluorobenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798902
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C\1/C(=O)N(c3c1cccc3)Cc1ccccc1F)/s2)C(=O)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H24FN3O5S MW 569.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24FN3O5S/c1-17-24(30(38)40-3)26(18-12-14-20(39-2)15-13-18)35-29(37)27(41-31(35)33-17)25-21-9-5-7-11-23(21)34(28(25)36)16-19-8-4-6-10-22(19)32/h4-15,26H,16H2,1-3H3/b27-25-InChIKey
VHUVMAVEPNKEHR-RFBIWTDZSA-NSynonyms
CC1=C(C(N2C(=O)C(=C3C4=CC=CC=C4N(C3=O)CC5=CC=CC=C5F)SC2=N1)C6=CC=C(C=C6)OC)C(=O)OC
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=C1C(=O)N(c3c1cccc3)Cc1ccccc1F)s2)C(=O)OC
InChI=1SC31H24FN3O5Sc11724(30(38)403)26(18121420(392)151318)3529(37)27(4131(35)3317)25219571123(21)34(28(25)36)16198461022(19)32h41526H16H213H3b2725
methyl(2Z)2(1((2fluorophenyl)methyl)2oxoindol3ylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2Z)2(1(2fluorobenzyl)2oxo12dihydro3Hindol3ylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417882
ZINC000002671554
ZINC000002671556
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