Vitas-M small molecule compound
ethyl 1-[(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-7-yl)sulfonyl]piperidine-3-carboxylate
Catalog ID
STK939166
SMILES CCOC(=O)C1CCCN(C1)S(=O)(=O)c1ccc2c(c1)NC(=O)CCS2
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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 C17H22N2O5S2 MW 398.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5S2/c1-2-24-17(21)12-4-3-8-19(11-12)26(22,23)13-5-6-15-14(10-13)18-16(20)7-9-25-15/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,18,20)InChIKey
YRMUAYQEPGPISJ-UHFFFAOYSA-NSynonyms
1219539-82-81219539828
CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCCC(=O)N3
ethyl1((4oxo2345tetrahydro15benzothiazepin7yl)sulfonyl)piperidine3carboxylate
ethyl1((4oxo2345tetrahydrobenzo(b)(14)thiazepin7yl)sulfonyl)piperidine3carboxylate
ethyl1((4oxo35dihydro2H15benzothiazepin7yl)sulfonyl)piperidine3carboxylate
InChI=1SC17H22N2O5S2c122417(21)1243819(1112)26(2223)13561514(1013)1816(20)792515h561012H247911H21H3(H1820)
MFCD16624827
ZINC000040268926
ZINC000040268928
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