Vitas-M small molecule compound
2-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(2-methoxyphenyl)acetamide
Catalog ID
STK218762
SMILES COc1ccccc1NC(=O)Cc1nnc(n1C)SCC(=O)NC1CCCCC1
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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 C20H27N5O3S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O3S/c1-25-17(12-18(26)22-15-10-6-7-11-16(15)28-2)23-24-20(25)29-13-19(27)21-14-8-4-3-5-9-14/h6-7,10-11,14H,3-5,8-9,12-13H2,1-2H3,(H,21,27)(H,22,26)InChIKey
GQCGBSUEQFWASY-UHFFFAOYSA-NSynonyms
2(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
2(5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
2(5CYCLOHEXYLCARBAMOYLMETHYLSULFANYL4METHYL4H(124)TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2CCCCC2)CC(=O)NC3=CC=CC=C3OC
InChI=1SC20H27N5O3Sc12517(1218(26)221510671116(15)282)232420(25)291319(27)21148435914h67101114H35891213H212H3(H2127)(H2226)
MFCD07399275
ZINC000004814664
ZINC04814664
ZINC4814664
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