Vitas-M small molecule compound
methyl 5-benzyl-2-({[2-(cyclohexylcarbamothioyl)hydrazinyl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK483152
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 C21H26N4O2S3 MW 462.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2S3/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/h2,4-5,8-9,13,15H,3,6-7,10-12H2,1H3,(H2,22,24,28)(H2,23,25,29)InChIKey
GGFDTUXCAWKWOA-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=S)NC3CCCCC3
InChI=1SC21H26N4O2S3c12719(26)171316(12148425914)3018(17)2321(29)252420(28)2215106371115h245891315H3671012H21H3(H2222428)(H2232529)
METHYL2(((2((CYCLOHEXYLAMINO)THIOXOMETHYL)HYDRAZINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
methyl5benzyl2(((2(cyclohexylcarbamothioyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
methyl5benzyl2((cyclohexylcarbamothioylamino)carbamothioylamino)thiophene3carboxylate
MFCD06058248
ZINC000013323852
ZINC13323852
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