Vitas-M small molecule compound
(2E)-N-[5-(4-methoxybenzyl)-1,3,4-thiadiazol-2-yl]-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STK118739
SMILES COc1ccc(cc1)Cc1nnc(s1)NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]
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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 C19H16N4O4S MW 396.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O4S/c1-27-16-9-4-14(5-10-16)12-18-21-22-19(28-18)20-17(24)11-6-13-2-7-15(8-3-13)23(25)26/h2-11H,12H2,1H3,(H,20,22,24)/b11-6+InChIKey
HJJSRZMILWGFGS-IZZDOVSWSA-NSynonyms
599186-21-7(2E)N(5((4METHOXYPHENYL)METHYL)(134THIADIAZOL2YL))3(4NITROPHENYL)PROP2ENAMIDE
(2E)N(5(4METHOXYBENZYL)134THIADIAZOL2YL)3(4NITROPHENYL)PROP2ENAMIDE
(E)N(5((4METHOXYPHENYL)METHYL)134THIADIAZOL2YL)3(4NITROPHENYL)PROP2ENAMIDE
599186217
COC1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1)Cc1nnc(s1)NC(=O)C=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H16N4O4Sc127169414(51016)1218212219(2818)2017(24)116132715(8313)23(25)26h211H12H21H3(H202224)b116+
MFCD03638225
ZINC000001135478
ZINC01135478
ZINC1135478
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