Vitas-M small molecule compound
methyl 4-[({[4-ethyl-5-({[(4-methoxyphenyl)acetyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK117211
SMILES COc1ccc(cc1)CC(=O)NCc1nnc(n1CC)SCC(=O)Nc1ccc(cc1)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 C24H27N5O5S MW 497.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O5S/c1-4-29-20(14-25-21(30)13-16-5-11-19(33-2)12-6-16)27-28-24(29)35-15-22(31)26-18-9-7-17(8-10-18)23(32)34-3/h5-12H,4,13-15H2,1-3H3,(H,25,30)(H,26,31)InChIKey
QTLLMOZQZUDMBJ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)CNC(=O)CC3=CC=C(C=C3)OC
InChI=1SC24H27N5O5Sc142920(142521(30)131651119(332)12616)272824(29)351522(31)26189717(81018)23(32)343h512H41315H213H3(H2530)(H2631)
METHYL4((((4ETHYL5((((4METHOXYPHENYL)ACETYL)AMINO)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((4ETHYL5(((2(4METHOXYPHENYL)ACETYL)AMINO)METHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD03996193
ZINC000009304933
ZINC09304933
ZINC9304933
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