Vitas-M small molecule compound
N-[5-(2-{(2E)-2-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Catalog ID
STK532226
SMILES COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)cc(c1OCCOc1ccccc1)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 C27H24ClN5O5S MW 566.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN5O5S/c1-36-22-15-18(14-21(28)25(22)38-13-12-37-20-10-6-3-7-11-20)17-29-31-23(34)16-24-32-33-27(39-24)30-26(35)19-8-4-2-5-9-19/h2-11,14-15,17H,12-13,16H2,1H3,(H,31,34)(H,30,33,35)/b29-17+InChIKey
UQGPDBBLUZQUAY-STBIYBPSSA-NSynonyms
(E)N(5(2(2(3chloro5methoxy4(2phenoxyethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
COC1=C(C(=CC(=C1)C=NNC(=O)CC2=NN=C(S2)NC(=O)C3=CC=CC=C3)Cl)OCCOC4=CC=CC=C4
COc1cc(C=NNC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)cc(c1OCCOc1ccccc1)Cl
InChI=1SC27H24ClN5O5Sc136221518(1421(28)25(22)3813123720106371120)17293123(34)1624323327(3924)3026(35)198425919h211141517H121316H21H3(H3134)(H303335)b2917+
MFCD02198350
N(5(2((2E)2((3chloro5methoxy4(2phenoxyethoxy)phenyl)methylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
N(5(2((2E)2(3chloro5methoxy4(2phenoxyethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
ZINC000097966397
ZINC100326984
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