Vitas-M small molecule compound
methyl 4-chloro-3-[({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL415709
SMILES CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(=O)OC)nnc1c1ccc(cc1)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(12-4-7-14(21)8-5-12)24-25-20(26)30-11-17(27)23-16-10-13(19(28)29-2)6-9-15(16)22/h4-10H,3,11H2,1-2H3,(H,23,27)InChIKey
MRQYYJMCERIMEV-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)C3=CC=C(C=C3)Cl
InChI=1SC20H18Cl2N4O3Sc132618(124714(21)8512)242520(26)301117(27)23161013(19(28)292)6915(16)22h410H311H212H3(H2327)
methyl4chloro3((((5(4chlorophenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4CHLORO3((2((5(4CHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05842121
ZINC000001064562
ZINC01064562
ZINC1064562
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