Vitas-M small molecule compound
methyl 2-[({2-[(4-bromo-2-chlorophenoxy)acetyl]hydrazinyl}carbonothioyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate
Catalog ID
STK436682
SMILES COC(=O)c1c(NC(=S)NNC(=O)COc2ccc(cc2Cl)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 C18H19BrClN3O4S2 MW 520.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrClN3O4S2/c1-4-11-9(2)29-16(15(11)17(25)26-3)21-18(28)23-22-14(24)8-27-13-6-5-10(19)7-12(13)20/h5-7H,4,8H2,1-3H3,(H,22,24)(H2,21,23,28)InChIKey
DQJIFRSGDRSDCR-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Br)Cl)C
InChI=1SC18H19BrClN3O4S2c14119(2)2916(15(11)17(25)263)2118(28)232214(24)827136510(19)712(13)20h57H48H213H3(H2224)(H2212328)
METHYL2((((2(4BROMO2CHLOROPHENOXY)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((2((4bromo2chlorophenoxy)acetyl)hydrazinyl)carbonothioyl)amino)4ethyl5methylthiophene3carboxylate
METHYL2(((2(4BROMO2CHLOROPHENOXY)ACETYL)AMINO)CARBAMOTHIOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD03945098
ZINC000097945301
ZINC97945301
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