Vitas-M small molecule compound
2-(4-chlorophenoxy)-N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STL051081
SMILES COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)COc2ccc(cc2)Cl)/s1
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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 C18H16ClN3O4S MW 405.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3O4S/c1-24-14-8-3-11(9-15(14)25-2)17-21-22-18(27-17)20-16(23)10-26-13-6-4-12(19)5-7-13/h3-9H,10H2,1-2H3,(H,20,22,23)InChIKey
XDPFPIWLKRWPQJ-UHFFFAOYSA-NSynonyms
714942-87-72(4chlorophenoxy)N((2E)5(34dimethoxyphenyl)134thiadiazol2(3H)ylidene)acetamide
2(4CHLOROPHENOXY)N(5(34DIMETHOXYPHENYL)134THIADIAZOL2YL)ACETAMIDE
714942877
COC1=C(C=C(C=C1)C2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)Cl)OC
COc1cc(ccc1OC)c1n(nH)c(=NC(=O)COc2ccc(cc2)Cl)s1
InChI=1SC18H16ClN3O4Sc124148311(915(14)252)17212218(2717)2016(23)1026136412(19)5713h39H10H212H3(H202223)
MFCD05736828
ZINC000016955936
ZINC16955936
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