Vitas-M small molecule compound
4-(5-{(Z)-[5-(4-methoxyphenyl)-7-methyl-3-oxo-6-(phenylcarbamoyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK092403
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)C(=O)O)/s2)C(=O)Nc1ccccc1
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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 C33H25N3O6S MW 591.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25N3O6S/c1-19-28(30(37)35-23-6-4-3-5-7-23)29(21-12-14-24(41-2)15-13-21)36-31(38)27(43-33(36)34-19)18-25-16-17-26(42-25)20-8-10-22(11-9-20)32(39)40/h3-18,29H,1-2H3,(H,35,37)(H,39,40)/b27-18-InChIKey
PBCHHQKOLMNRHV-IMRQLAEWSA-NSynonyms
4(5((Z)(5(4METHOXYPHENYL)7METHYL3OXO6(PHENYLCARBAMOYL)5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
4(5((Z)(5(4METHOXYPHENYL)7METHYL3OXO6(PHENYLCARBAMOYL)5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)FURAN2YL)BENZOICACID
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)SC2=N1)C5=CC=C(C=C5)OC)C(=O)NC6=CC=CC=C6
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)s2)C(=O)Nc1ccccc1
InChI=1SC33H25N3O6Sc11928(30(37)35236435723)29(21121424(412)151321)3631(38)27(4333(36)3419)1825161726(4225)2081022(11920)32(39)40h31829H12H3(H3537)(H3940)b2718
MFCD04126505
STK092403
ZINC000003771262
ZINC000003771264
Check stock
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Check stock on Vitas-MAvailable files
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