Vitas-M small molecule compound
N-(5-{2-[(2E)-2-{3-chloro-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Catalog ID
STK532670
SMILES COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)cc(c1OCc1ccccc1Cl)Cl
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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 C26H21Cl2N5O4S MW 570.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N5O4S/c1-36-21-12-16(11-20(28)24(21)37-15-18-9-5-6-10-19(18)27)14-29-31-22(34)13-23-32-33-26(38-23)30-25(35)17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3,(H,31,34)(H,30,33,35)/b29-14+InChIKey
YEMZYTZNGYHCBU-IPPBACCNSA-NSynonyms
(E)N(5(2(2(3chloro4((2chlorobenzyl)oxy)5methoxybenzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
COC1=C(C(=CC(=C1)C=NNC(=O)CC2=NN=C(S2)NC(=O)C3=CC=CC=C3)Cl)OCC4=CC=CC=C4Cl
COc1cc(C=NNC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)cc(c1OCc1ccccc1Cl)Cl
InChI=1SC26H21Cl2N5O4Sc136211216(1120(28)24(21)3715189561019(18)27)14293122(34)1323323326(3823)3025(35)177324817h21214H1315H21H3(H3134)(H303335)b2914+
MFCD02198537
N(5(2((2E)2((3CHLORO4((2CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)HYDRAZINYL)2OXOETHYL)134THIADIAZOL2YL)BENZAMIDE
N(5(2((2E)2(3chloro4((2chlorobenzyl)oxy)5methoxybenzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
ZINC000001740119
ZINC100326977
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