Vitas-M small molecule compound
1-{5-chloro-4-[(3-methoxypropyl)amino]-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-2-carboxylic acid
Catalog ID
STL043008
SMILES COCCCNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)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 C19H26ClN3O4 MW 395.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26ClN3O4/c1-27-4-2-3-21-14-10-22-23(17(24)16(14)20)19-8-11-5-12(9-19)7-13(6-11)15(19)18(25)26/h10-13,15,21H,2-9H2,1H3,(H,25,26)InChIKey
CMBTUTCYOMITKY-UHFFFAOYSA-NSynonyms
1212482-45-5(1S2R3S5R7S)1(5chloro4((3methoxypropyl)amino)6oxopyridazin1(6H)yl)adamantane2carboxylicacid
1(5chloro4((3methoxypropyl)amino)6oxopyridazin1(6H)yl)tricyclo(3311~37~)decane2carboxylicacid
1(5CHLORO4(3METHOXYPROPYLAMINO)6OXOPYRIDAZIN1YL)ADAMANTANE2CARBOXYLICACID
1212482455
COCCCNC1=C(C(=O)N(N=C1)C23CC4CC(C2)CC(C4)C3C(=O)O)Cl
InChI=1SC19H26ClN3O4c1274232114102223(17(24)16(14)20)19811512(919)713(611)15(19)18(25)26h10131521H29H21H3(H2526)
MFCD06612014
ZINC000101311041
ZINC000245257679
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