Vitas-M small molecule compound
methyl 4-[({[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK101274
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1ccc(cc1Cl)Cl
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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 C20H18Cl2N4O3S MW 465.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl2N4O3S/c1-3-26-18(15-9-6-13(21)10-16(15)22)24-25-20(26)30-11-17(27)23-14-7-4-12(5-8-14)19(28)29-2/h4-10H,3,11H2,1-2H3,(H,23,27)InChIKey
XLTGZWPTWPUJQH-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H18Cl2N4O3Sc132618(159613(21)1016(15)22)242520(26)301117(27)23147412(5814)19(28)292h410H311H212H3(H2327)
METHYL4((((5(24DICHLOROPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5(24DICHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD03564280
ZINC000001129470
ZINC01129470
ZINC1129470
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