Vitas-M small molecule compound
methyl 4-ethyl-5-methyl-2-{[(2-{[(4-methylbenzyl)sulfanyl]acetyl}hydrazinyl)carbonothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK446149
SMILES COC(=O)c1c(NC(=S)NNC(=O)CSCc2ccc(cc2)C)sc(c1CC)C
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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 C20H25N3O3S3 MW 451.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S3/c1-5-15-13(3)29-18(17(15)19(25)26-4)21-20(27)23-22-16(24)11-28-10-14-8-6-12(2)7-9-14/h6-9H,5,10-11H2,1-4H3,(H,22,24)(H2,21,23,27)InChIKey
KOVMCWCXVLAHHL-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)CSCC2=CC=C(C=C2)C)C
InChI=1SC20H25N3O3S3c151513(3)2918(17(15)19(25)264)2120(27)232216(24)112810148612(2)7914h69H51011H214H3(H2224)(H2212327)
METHYL4ETHYL5METHYL2((((2((4METHYLPHENYL)METHYLTHIO)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2(((2(((4methylbenzyl)sulfanyl)acetyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
methyl4ethyl5methyl2(((2((4methylphenyl)methylsulfanyl)acetyl)amino)carbamothioylamino)thiophene3carboxylate
MFCD04058370
ZINC000020191496
ZINC20191496
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