Vitas-M small molecule compound

N-(2-{[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazinyl]carbonyl}phenyl)-2-(4-methoxyphenyl)acetamide

Catalog ID
STK569811
SMILES COc1ccc(cc1CSc1nnc(s1)C)/C=N/NC(=O)c1ccccc1NC(=O)Cc1ccc(cc1)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 C28H27N5O4S2 MW 561.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O4S2/c1-18-31-33-28(39-18)38-17-21-14-20(10-13-25(21)37-3)16-29-32-27(35)23-6-4-5-7-24(23)30-26(34)15-19-8-11-22(36-2)12-9-19/h4-14,16H,15,17H2,1-3H3,(H,30,34)(H,32,35)/b29-16+
InChIKey
OOQDCELLVTUNMY-MUFRIFMGSA-N
Synonyms

(E)N(2(2(4methoxy3(((5methyl134thiadiazol2yl)thio)methyl)benzylidene)hydrazinecarbonyl)phenyl)2(4methoxyphenyl)acetamide
CC1=NN=C(S1)SCC2=C(C=CC(=C2)C=NNC(=O)C3=CC=CC=C3NC(=O)CC4=CC=C(C=C4)OC)OC
COc1ccc(cc1CSc1nnc(s1)C)C=NNC(=O)c1ccccc1NC(=O)Cc1ccc(cc1)OC
InChI=1SC28H27N5O4S2c118313328(3918)3817211420(101325(21)373)16293227(35)23645724(23)3026(34)151981122(362)12919h41416H1517H213H3(H3034)(H3235)b2916+
MFCD03325500
N((E)(4methoxy3((5methyl134thiadiazol2yl)sulfanylmethyl)phenyl)methylideneamino)2((2(4methoxyphenyl)acetyl)amino)benzamide
N(2(((2E)2(4methoxy3(((5methyl134thiadiazol2yl)sulfanyl)methyl)benzylidene)hydrazinyl)carbonyl)phenyl)2(4methoxyphenyl)acetamide
ZINC000097967638
ZINC102559165

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Available files

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