Vitas-M small molecule compound
(4-{(Z)-[1-(4-tert-butylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,6-dichlorophenoxy)acetic acid
Catalog ID
STK192978
SMILES OC(=O)COc1c(Cl)cc(cc1Cl)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)C(C)(C)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 C23H20Cl2N2O5S MW 507.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20Cl2N2O5S/c1-23(2,3)13-4-6-14(7-5-13)27-21(31)15(20(30)26-22(27)33)8-12-9-16(24)19(17(25)10-12)32-11-18(28)29/h4-10H,11H2,1-3H3,(H,28,29)(H,26,30,33)/b15-8-InChIKey
OXNVTIQSCNSKBZ-NVNXTCNLSA-NSynonyms
(4((Z)(1(4TERTBUTYLPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)26DICHLOROPHENOXY)ACETICACID
2(4((1(4(TERTBUTYL)PHENYL)46DIOXO2THIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)26DICHLOROPHENOXY)ACETICACID
2(4((1(4(tertbutyl)phenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)26dichlorophenoxy)aceticacid
2(4((Z)(1(4TERTBUTYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)26DICHLOROPHENOXY)ACETICACID
CC(C)(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC(=O)O)Cl)C(=O)NC2=S
InChI=1SC23H20Cl2N2O5Sc123(23)134614(7513)2721(31)15(20(30)2622(27)33)812916(24)19(17(25)1012)321118(28)29h410H11H213H3(H2829)(H263033)b158
MFCD02379191
OC(=O)COc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)C(C)(C)C
ZINC000009311142
ZINC9311142
Check stock
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Check stock on Vitas-MAvailable files
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