Vitas-M small molecule compound

4-methoxy-N-(5-{2-[(2E)-2-{4-[2-(3-methoxyphenoxy)ethoxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide

Catalog ID
STK532460
SMILES COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C/c1ccc(cc1)OCCOc1cccc(c1)OC

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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 C28H27N5O6S MW 561.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O6S/c1-36-21-12-8-20(9-13-21)27(35)30-28-33-32-26(40-28)17-25(34)31-29-18-19-6-10-22(11-7-19)38-14-15-39-24-5-3-4-23(16-24)37-2/h3-13,16,18H,14-15,17H2,1-2H3,(H,31,34)(H,30,33,35)/b29-18+
InChIKey
FTFAYUTZOKSNQD-RDRPBHBLSA-N
Synonyms

(E)4methoxyN(5(2(2(4(2(3methoxyphenoxy)ethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
4methoxyN(5(2((2E)2((4(2(3methoxyphenoxy)ethoxy)phenyl)methylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
4methoxyN(5(2((2E)2(4(2(3methoxyphenoxy)ethoxy)benzylidene)hydrazinyl)2oxoethyl)134thiadiazol2yl)benzamide
COC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CC(=O)NN=CC3=CC=C(C=C3)OCCOC4=CC=CC(=C4)OC
COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)NN=Cc1ccc(cc1)OCCOc1cccc(c1)OC
InChI=1SC28H27N5O6Sc1362112820(91321)27(35)3028333226(4028)1725(34)3129181961022(11719)381415392453423(1624)372h3131618H141517H212H3(H3134)(H303335)b2918+
MFCD02198136
ZINC000097966407
ZINC100338795

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.