Vitas-M small molecule compound
6-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK426259
SMILES COc1cc(CCNC(=O)C2CC(=C(CC2C(=O)O)C)C)ccc1OC
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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 C20H27NO5 MW 361.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO5/c1-12-9-15(16(20(23)24)10-13(12)2)19(22)21-8-7-14-5-6-17(25-3)18(11-14)26-4/h5-6,11,15-16H,7-10H2,1-4H3,(H,21,22)(H,23,24)InChIKey
UYOJBKFIFVXBNI-UHFFFAOYSA-NSynonyms
(1R6S)6((2(34DIMETHOXYPHENYL)ETHYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
(1S6R)6((2(34DIMETHOXYPHENYL)ETHYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
(1S6S)6((2(34DIMETHOXYPHENYL)ETHYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
6((2(34dimethoxyphenyl)ethyl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(2(34DIMETHOXYPHENYL)ETHYLCARBAMOYL)34DIMETHYLCYCLOHEX3ENE1CARBOXYLICACID
6(N(2(34DIMETHOXYPHENYL)ETHYL)CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)C(=O)O)C
InChI=1SC20H27NO5c112915(16(20(23)24)1013(12)2)19(22)2187145617(253)18(1114)264h56111516H710H214H3(H2122)(H2324)
MFCD02609159
ZINC000004894537
ZINC000004894541
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Check stock on Vitas-MAvailable files
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