Vitas-M small molecule compound
ethyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]thiophene-3-carboxylate
Catalog ID
STK002128
SMILES CCOC(=O)c1c(NC(=O)C23CC4CC(C3)CC(C2)C4)sc(c1C)C(=O)Nc1cccc(c1)OC
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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)28-19-6-5-7-20(11-19)33-3)35-24(21)29-26(32)27-12-16-8-17(13-27)10-18(9-16)14-27/h5-7,11,16-18H,4,8-10,12-14H2,1-3H3,(H,28,30)(H,29,32)InChIKey
LNJXCFMGKQUYQR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=CC=C2)OC)NC(=O)C34CC5CC(C3)CC(C5)C4
CCOC(=O)c1c(NC(=O)C23CC4CC(C3)CC(C2)C4)sc(c1C)C(=O)Nc1cccc(c1)OC
ETHYL2(ADAMANTANE1AMIDO)5((3METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(ADAMANTANE1CARBONYLAMINO)5((3METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(ADAMANTANYLCARBONYLAMINO)5(N(3METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ethyl5((3methoxyphenyl)carbamoyl)4methyl2((tricyclo(3311~37~)dec1ylcarbonyl)amino)thiophene3carboxylate
InChI=1SC27H32N2O5Sc143425(31)2115(2)22(23(30)281965720(1119)333)3524(21)2926(32)271216817(1327)1018(916)1427h57111618H48101214H213H3(H2830)(H2932)
MFCD01823961
STK002128
ZINC000008842947
ZINC08842947
ZINC8842947
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.