Vitas-M small molecule compound
ethyl 1-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)piperidine-3-carboxylate
Catalog ID
STK685083
SMILES CCOC(=O)C1CCCN(C1)CC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2
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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 C21H30N2O5S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2O5S/c1-3-27-20(25)14-8-7-11-23(12-14)13-17(24)22-19-18(21(26)28-4-2)15-9-5-6-10-16(15)29-19/h14H,3-13H2,1-2H3,(H,22,24)InChIKey
NTMHOZMLZDOMDI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CCCN(C1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC
ethyl1(2((3(ethoxycarbonyl)4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)piperidine3carboxylate
ethyl1(2((3ethoxycarbonyl4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)piperidine3carboxylate
InChI=1SC21H30N2O5Sc132720(25)14871123(1214)1317(24)221918(21(26)2842)159561016(15)2919h14H313H212H3(H2224)
MFCD05857170
ZINC000001061447
ZINC000004698335
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