Vitas-M small molecule compound
methyl 3-[({[4-ethyl-5-(4-methoxybenzyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK133544
SMILES COc1ccc(cc1)Cc1nnc(n1CC)SCC(=O)Nc1cccc(c1)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 C22H24N4O4S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O4S/c1-4-26-19(12-15-8-10-18(29-2)11-9-15)24-25-22(26)31-14-20(27)23-17-7-5-6-16(13-17)21(28)30-3/h5-11,13H,4,12,14H2,1-3H3,(H,23,27)InChIKey
ANNZORYTWNLPMI-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)OC)CC3=CC=C(C=C3)OC
InChI=1SC22H24N4O4Sc142619(121581018(292)11915)242522(26)311420(27)231775616(1317)21(28)303h51113H41214H213H3(H2327)
METHYL3((((4ETHYL5(4METHOXYBENZYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((((4ETHYL5(4METHOXYBENZYL)4H124TRIAZOL3YL)THIO)ACETYL)AMINO)BENZOATE
METHYL3((2((4ETHYL5((4METHOXYPHENYL)METHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05993427
ZINC000002861839
ZINC02861839
ZINC2861839
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