Vitas-M small molecule compound
methyl 4-chloro-3-[({[5-(2-ethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL445322
SMILES CCOc1ccccc1c1nnc(n1CC)SCC(=O)Nc1cc(ccc1Cl)C(=O)OC
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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 C22H23ClN4O4S MW 474.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O4S/c1-4-27-20(15-8-6-7-9-18(15)31-5-2)25-26-22(27)32-13-19(28)24-17-12-14(21(29)30-3)10-11-16(17)23/h6-12H,4-5,13H2,1-3H3,(H,24,28)InChIKey
UFLAPLXPPZVNIP-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)C3=CC=CC=C3OCC
InChI=1SC22H23ClN4O4Sc142720(15867918(15)3152)252622(27)321319(28)24171214(21(29)303)101116(17)23h612H4513H213H3(H2428)
methyl4chloro3((((5(2ethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4CHLORO3((2((5(2ETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05842180
ZINC000014152400
ZINC14152400
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