Vitas-M small molecule compound
2-(4-{(E)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetamide
Catalog ID
STK197191
SMILES NC(=O)COc1ccc(cc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1C)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 C21H19N3O4S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S/c1-12-4-3-5-17(13(12)2)24-20(27)16(19(26)23-21(24)29)10-14-6-8-15(9-7-14)28-11-18(22)25/h3-10H,11H2,1-2H3,(H2,22,25)(H,23,26,29)/b16-10+InChIKey
WDEANYRDWPMRGA-MHWRWJLKSA-NSynonyms
2(4((E)(1(23DIMETHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETAMIDE
2(4((E)(1(23DIMETHYLPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETAMIDE
CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)N)C(=O)NC2=S)C
InChI=1SC21H19N3O4Sc11243517(13(12)2)2420(27)16(19(26)2321(24)29)10146815(9714)281118(22)25h310H11H212H3(H22225)(H232629)b1610+
MFCD05625521
NC(=O)COc1ccc(cc1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
ZINC000004738904
ZINC04738904
ZINC4738904
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