Vitas-M small molecule compound
methyl 2-[({2-[(5-bromofuran-2-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate
Catalog ID
STK436699
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2ccc(o2)Br)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 C15H16BrN3O4S2 MW 446.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrN3O4S2/c1-4-8-7(2)25-13(11(8)14(21)22-3)17-15(24)19-18-12(20)9-5-6-10(16)23-9/h5-6H,4H2,1-3H3,(H,18,20)(H2,17,19,24)InChIKey
JNDWLLWVYOKXHJ-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CC=C(O2)Br)C
InChI=1SC15H16BrN3O4S2c1487(2)2513(11(8)14(21)223)1715(24)191812(20)95610(16)239h56H4H213H3(H1820)(H2171924)
METHYL2(((((5BROMO(2FURYL))CARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((2((5bromofuran2yl)carbonyl)hydrazinyl)carbonothioyl)amino)4ethyl5methylthiophene3carboxylate
METHYL2(((5BROMOFURAN2CARBONYL)AMINO)CARBAMOTHIOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD03945117
ZINC000019644285
ZINC19644285
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