Vitas-M small molecule compound
ethyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]thiophene-3-carboxylate
Catalog ID
STK332993
SMILES CCOC(=O)c1c(NC(=O)CC23CC4CC(C3)CC(C2)C4)sc(c1C)C(=O)Nc1ccccc1OC
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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 C28H34N2O5S MW 510.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O5S/c1-4-35-27(33)23-16(2)24(25(32)29-20-7-5-6-8-21(20)34-3)36-26(23)30-22(31)15-28-12-17-9-18(13-28)11-19(10-17)14-28/h5-8,17-19H,4,9-15H2,1-3H3,(H,29,32)(H,30,31)InChIKey
QJTUAOSXDZLLJW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2OC)NC(=O)CC34CC5CC(C3)CC(C5)C4
ETHYL2((2(1ADAMANTYL)ACETYL)AMINO)5((2METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(2ADAMANTANYLACETYLAMINO)5(N(2METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ethyl5((2methoxyphenyl)carbamoyl)4methyl2((tricyclo(3311~37~)dec1ylacetyl)amino)thiophene3carboxylate
InChI=1SC28H34N2O5Sc143527(33)2316(2)24(25(32)2920756821(20)343)3626(23)3022(31)15281217918(1328)1119(1017)1428h581719H4915H213H3(H2932)(H3031)
MFCD02244152
ZINC000018195321
ZINC18195321
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