Vitas-M small molecule compound
2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl 1-methyl-1H-pyrazole-3-carboxylate
Catalog ID
STK331572
SMILES CCOC(=O)c1c(NC(=O)COC(=O)c2ccn(n2)C)sc2c1CCCC2
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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 C18H21N3O5S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O5S/c1-3-25-18(24)15-11-6-4-5-7-13(11)27-16(15)19-14(22)10-26-17(23)12-8-9-21(2)20-12/h8-9H,3-7,10H2,1-2H3,(H,19,22)InChIKey
DKZFQLGNJXTCEU-UHFFFAOYSA-NSynonyms
(2((3ethoxycarbonyl4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)1methylpyrazole3carboxylate
2((3(ethoxycarbonyl)4567tetrahydro1benzothiophen2yl)amino)2oxoethyl1methyl1Hpyrazole3carboxylate
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C3=NN(C=C3)C
InChI=1SC18H21N3O5Sc132518(24)1511645713(11)2716(15)1914(22)102617(23)128921(2)2012h89H3710H212H3(H1922)
MFCD01449412
ZINC000000996949
ZINC00996949
ZINC996949
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