Vitas-M small molecule compound
ethyl 2-{[(3,4-dimethylphenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK428685
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(c(c2)C)C)sc2c1CCCCC2
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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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-4-26-22(25)20-17-8-6-5-7-9-18(17)28-21(20)23-19(24)13-27-16-11-10-14(2)15(3)12-16/h10-12H,4-9,13H2,1-3H3,(H,23,24)InChIKey
RQHXQZXHDBRGLN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)COC3=CC(=C(C=C3)C)C
ethyl2(((34dimethylphenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2(34dimethylphenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC22H27NO4Sc142622(25)20178657918(17)2821(20)2319(24)132716111014(2)15(3)1216h1012H4913H213H3(H2324)
MFCD03233196
ZINC000000647928
ZINC00647928
ZINC647928
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