Vitas-M small molecule compound

2-methoxy-N'-{4-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide

Catalog ID
STK994523
SMILES COc1ccccc1C(=O)NNC(=O)CCCN1C(=S)S/C(=C/c2cccs2)/C1=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 C20H19N3O4S3 MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S3/c1-27-15-8-3-2-7-14(15)18(25)22-21-17(24)9-4-10-23-19(26)16(30-20(23)28)12-13-6-5-11-29-13/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,21,24)(H,22,25)/b16-12+
InChIKey
RWSMJQOACDJBFB-FOWTUZBSSA-N
Synonyms

2METHOXYN(4((5E)4OXO2SULFANYLIDENE5(THIOPHEN2YLMETHYLIDENE)13THIAZOLIDIN3YL)BUTANOYL)BENZOHYDRAZIDE
2methoxyN(4((5E)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)butanoyl)benzohydrazide
COC1=CC=CC=C1C(=O)NNC(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S
COc1ccccc1C(=O)NNC(=O)CCCN1C(=S)SC(=Cc2cccs2)C1=O
InChI=1SC20H19N3O4S3c12715832714(15)18(25)222117(24)94102319(26)16(3020(23)28)121365112913h23581112H4910H21H3(H2124)(H2225)b1612+
MFCD03226127
ZINC000026771439
ZINC26771439

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Available files

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