Vitas-M small molecule compound
(3-{(Z)-[5-(4-chlorophenyl)-7-methyl-3-oxo-6-(phenylcarbamoyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK064912
SMILES OC(=O)COc1cccc(c1)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C
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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 C29H22ClN3O5S MW 560.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClN3O5S/c1-17-25(27(36)32-21-7-3-2-4-8-21)26(19-10-12-20(30)13-11-19)33-28(37)23(39-29(33)31-17)15-18-6-5-9-22(14-18)38-16-24(34)35/h2-15,26H,16H2,1H3,(H,32,36)(H,34,35)/b23-15-InChIKey
QVTNZDVTESHULI-HAHDFKILSA-NSynonyms
(3((Z)(5(4CHLOROPHENYL)7METHYL3OXO6(PHENYLCARBAMOYL)5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)PHENOXY)ACETICACID
2(3((Z)(5(4CHLOROPHENYL)7METHYL3OXO6(PHENYLCARBAMOYL)5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENOXY)ACETICACID
CC1=C(C(N2C(=O)C(=CC3=CC(=CC=C3)OCC(=O)O)SC2=N1)C4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5
InChI=1SC29H22ClN3O5Sc11725(27(36)32217324821)26(19101220(30)131119)3328(37)23(3929(33)3117)151865922(1418)381624(34)35h21526H16H21H3(H3236)(H3435)b2315
MFCD03235320
OC(=O)COc1cccc(c1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C
STK064912
ZINC000002049576
ZINC000002049578
Check stock
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Check stock on Vitas-MAvailable files
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