Vitas-M small molecule compound
ethyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]thiophene-3-carboxylate
Catalog ID
STK046369
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1OC)NC(=O)C12CC3CC(C2)CC(C1)C3
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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 C27H32N2O5S MW 496.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O5S/c1-4-34-25(31)21-15(2)22(23(30)28-19-7-5-6-8-20(19)33-3)35-24(21)29-26(32)27-12-16-9-17(13-27)11-18(10-16)14-27/h5-8,16-18H,4,9-14H2,1-3H3,(H,28,30)(H,29,32)InChIKey
SNMYHHLEXGMFDX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2OC)NC(=O)C34CC5CC(C3)CC(C5)C4
CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1OC)NC(=O)C12CC3CC(C2)CC(C1)C3
ETHYL2(ADAMANTANE1CARBONYLAMINO)5((2METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ethyl5((2methoxyphenyl)carbamoyl)4methyl2((tricyclo(3311~37~)dec1ylcarbonyl)amino)thiophene3carboxylate
InChI=1SC27H32N2O5Sc143425(31)2115(2)22(23(30)2819756820(19)333)3524(21)2926(32)271216917(1327)1118(1016)1427h581618H4914H213H3(H2830)(H2932)
MFCD02109775
STK046369
ZINC000008861482
ZINC08861482
ZINC8861482
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