Vitas-M small molecule compound
N-[(2S)-1-hydroxy-4-(methylsulfanyl)butan-2-yl]-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide
Catalog ID
STL567163
SMILES CSCC[C@H](NC(=O)c1[nH]nc2c1CCCCC2)CO
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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 C14H23N3O2S MW 297.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H23N3O2S/c1-20-8-7-10(9-18)15-14(19)13-11-5-3-2-4-6-12(11)16-17-13/h10,18H,2-9H2,1H3,(H,15,19)(H,16,17)/t10-/m0/s1InChIKey
ILQNLDBQDMFQSQ-JTQLQIEISA-NSynonyms
(S)N(1hydroxy4(methylthio)butan2yl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
110204682
CSCC(C@H)(NC(=O)c1n(nH)c2c1CCCCC2)CO
InChI=1SC14H23N3O2Sc1208710(918)1514(19)13115324612(11)161713h1018H29H21H3(H1519)(H1617)t10m0s1
MFCD32652444
N((2S)1hydroxy4(methylsulfanyl)butan2yl)245678hexahydrocyclohepta(c)pyrazole3carboxamide
N((2S)1hydroxy4methylsulfanylbutan2yl)145678hexahydrocyclohepta(c)pyrazole3carboxamide
ZINC000253405765
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