Vitas-M small molecule compound
2-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK218771
SMILES CCn1c(nnc1SCC(=O)NC1CCCCC1)CC(=O)Nc1ccc(c(c1)C)C
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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 C22H31N5O2S MW 429.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O2S/c1-4-27-19(13-20(28)24-18-11-10-15(2)16(3)12-18)25-26-22(27)30-14-21(29)23-17-8-6-5-7-9-17/h10-12,17H,4-9,13-14H2,1-3H3,(H,23,29)(H,24,28)InChIKey
HLSGERGXHSCUHF-UHFFFAOYSA-NSynonyms
2(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
2(5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
2(5CYCLOHEXYLCARBAMOYLMETHYLSULFANYL4ETHYL4H(124)TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2CCCCC2)CC(=O)NC3=CC(=C(C=C3)C)C
InChI=1SC22H31N5O2Sc142719(1320(28)2418111015(2)16(3)1218)252622(27)301421(29)23178657917h101217H491314H213H3(H2329)(H2428)
MFCD07399415
ZINC000004814672
ZINC04814672
ZINC4814672
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