Vitas-M small molecule compound
N-[4-({2-methoxy-5-[(Z)-(1-methyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]benzyl}oxy)phenyl]acetamide
Catalog ID
STK534527
SMILES COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C\1/C(=O)NC(=S)N(C1=O)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 C22H21N3O5S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S/c1-13(26)23-16-5-7-17(8-6-16)30-12-15-10-14(4-9-19(15)29-3)11-18-20(27)24-22(31)25(2)21(18)28/h4-11H,12H2,1-3H3,(H,23,26)(H,24,27,31)/b18-11-InChIKey
ANVOPOCREMIXBU-WQRHYEAKSA-NSynonyms
372504-04-6(Z)N(4((2methoxy5((1methyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)benzyl)oxy)phenyl)acetamide
372504046
CC(=O)NC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=C3C(=O)NC(=S)N(C3=O)C)OC
COc1ccc(cc1COc1ccc(cc1)NC(=O)C)C=C1C(=O)NC(=S)N(C1=O)C
InChI=1SC22H21N3O5Sc113(26)23165717(8616)3012151014(4919(15)293)111820(27)2422(31)25(2)21(18)28h411H12H213H3(H2326)(H242731)b1811
MFCD01944844
N(4((2METHOXY5((Z)(1METHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENYL)METHOXY)PHENYL)ACETAMIDE
N(4((2methoxy5((Z)(1methyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)benzyl)oxy)phenyl)acetamide
ZINC000002278105
ZINC02278105
ZINC2278105
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