Vitas-M small molecule compound
methyl 5-benzyl-2-({[2-(phenylcarbamothioyl)hydrazinyl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK483166
SMILES COC(=O)c1cc(sc1NC(=S)NNC(=S)Nc1ccccc1)Cc1ccccc1
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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 C21H20N4O2S3 MW 456.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S3/c1-27-19(26)17-13-16(12-14-8-4-2-5-9-14)30-18(17)23-21(29)25-24-20(28)22-15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H2,22,24,28)(H2,23,25,29)InChIKey
KARLNOMIXOWPDS-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=S)NC3=CC=CC=C3
InChI=1SC21H20N4O2S3c12719(26)171316(12148425914)3018(17)2321(29)252420(28)2215106371115h21113H12H21H3(H2222428)(H2232529)
methyl5benzyl2(((2(phenylcarbamothioyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
methyl5benzyl2((phenylcarbamothioylamino)carbamothioylamino)thiophene3carboxylate
MFCD06057563
ZINC000013323892
ZINC13323892
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