Vitas-M small molecule compound
(2-chloro-4-{(Z)-[1-(2-methylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK197596
SMILES OC(=O)COc1ccc(cc1Cl)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccccc1C
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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 C20H15ClN2O5S MW 430.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O5S/c1-11-4-2-3-5-15(11)23-19(27)13(18(26)22-20(23)29)8-12-6-7-16(14(21)9-12)28-10-17(24)25/h2-9H,10H2,1H3,(H,24,25)(H,22,26,29)/b13-8-InChIKey
ZFUMYKYFLGDBGR-JYRVWZFOSA-NSynonyms
(2CHLORO4((Z)(1(2METHYLPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETICACID
2(2CHLORO4((Z)(1(2METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Cl)C(=O)NC2=S
InChI=1SC20H15ClN2O5Sc111423515(11)2319(27)13(18(26)2220(23)29)8126716(14(21)912)281017(24)25h29H10H21H3(H2425)(H222629)b138
MFCD02904898
OC(=O)COc1ccc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1C
ZINC000006973852
ZINC6973852
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