Vitas-M small molecule compound
8,8-dimethyl-3-[(pyridin-3-ylmethyl)carbamoyl]-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carboxylic acid
Catalog ID
STK054914
SMILES O=C(C1CC2=C(CC1C(=O)O)C(CCC2)(C)C)NCc1cccnc1
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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 C20H26N2O3 MW 342.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O3/c1-20(2)7-3-6-14-9-15(16(19(24)25)10-17(14)20)18(23)22-12-13-5-4-8-21-11-13/h4-5,8,11,15-16H,3,6-7,9-10,12H2,1-2H3,(H,22,23)(H,24,25)InChIKey
NETGOTNPMXBIPT-UHFFFAOYSA-NSynonyms
88dimethyl3((pyridin3ylmethyl)carbamoyl)12345678octahydronaphthalene2carboxylicacid
88dimethyl3(pyridin3ylmethylcarbamoyl)234567hexahydro1Hnaphthalene2carboxylicacid
CC1(CCCC2=C1CC(C(C2)C(=O)NCC3=CN=CC=C3)C(=O)O)C
InChI=1SC20H26N2O3c120(2)73614915(16(19(24)25)1017(14)20)18(23)221213548211113h458111516H36791012H212H3(H2223)(H2425)
MFCD03016364
O=C(C1CC2=C(CC1C(=O)O)C(CCC2)(C)C)NCc1cccnc1
STK054914
ZINC000003256153
ZINC000003863569
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