Vitas-M small molecule compound
methyl 2-[({2-[(5-bromofuran-2-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK437124
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2ccc(o2)Br)sc2c1CCCC2
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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 C16H16BrN3O4S2 MW 458.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrN3O4S2/c1-23-15(22)12-8-4-2-3-5-10(8)26-14(12)18-16(25)20-19-13(21)9-6-7-11(17)24-9/h6-7H,2-5H2,1H3,(H,19,21)(H2,18,20,25)InChIKey
MXWWHTCHYURRLP-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=S)NNC(=O)C3=CC=C(O3)Br
InChI=1SC16H16BrN3O4S2c12315(22)128423510(8)2614(12)1816(25)201913(21)96711(17)249h67H25H21H3(H1921)(H2182025)
methyl2(((2((5bromofuran2yl)carbonyl)hydrazinyl)carbonothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((5bromofuran2carbonyl)amino)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD03944607
ZINC000020220662
ZINC20220662
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Check stock on Vitas-MAvailable files
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