Vitas-M small molecule compound
methyl 2-[({2-[(5-bromofuran-2-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-5-methylthiophene-3-carboxylate
Catalog ID
STK435779
SMILES COC(=O)c1cc(sc1NC(=S)NNC(=O)c1ccc(o1)Br)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 C13H12BrN3O4S2 MW 418.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrN3O4S2/c1-6-5-7(12(19)20-2)11(23-6)15-13(22)17-16-10(18)8-3-4-9(14)21-8/h3-5H,1-2H3,(H,16,18)(H2,15,17,22)InChIKey
MERLGHZTBYAWMR-UHFFFAOYSA-NSynonyms
CC1=CC(=C(S1)NC(=S)NNC(=O)C2=CC=C(O2)Br)C(=O)OC
InChI=1SC13H12BrN3O4S2c1657(12(19)202)11(236)1513(22)171610(18)8349(14)218h35H12H3(H1618)(H2151722)
METHYL2(((((5BROMO(2FURYL))CARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((2((5bromofuran2yl)carbonyl)hydrazinyl)carbonothioyl)amino)5methylthiophene3carboxylate
METHYL2(((5BROMOFURAN2CARBONYL)AMINO)CARBAMOTHIOYLAMINO)5METHYLTHIOPHENE3CARBOXYLATE
MFCD03943878
ZINC000017091332
ZINC17091332
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