Vitas-M small molecule compound
1-{5-chloro-4-[(2-methoxyethyl)amino]-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-2-carboxylic acid
Catalog ID
STK597717
SMILES COCCNc1cnn(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 C18H24ClN3O4 MW 381.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24ClN3O4/c1-26-3-2-20-13-9-21-22(16(23)15(13)19)18-7-10-4-11(8-18)6-12(5-10)14(18)17(24)25/h9-12,14,20H,2-8H2,1H3,(H,24,25)InChIKey
KBJLQLWRUVGYPN-UHFFFAOYSA-NSynonyms
1008463-26-0(1R2S3R5R7S)1(5chloro4((2methoxyethyl)amino)6oxopyridazin1(6H)yl)adamantane2carboxylicacid
1(5chloro4((2methoxyethyl)amino)6oxopyridazin1(6H)yl)tricyclo(3311~37~)decane2carboxylicacid
1(5CHLORO4(2METHOXYETHYLAMINO)6OXOPYRIDAZIN1YL)ADAMANTANE2CARBOXYLICACID
1008463260
COCCNC1=C(C(=O)N(N=C1)C23CC4CC(C2)CC(C4)C3C(=O)O)Cl
InChI=1SC18H24ClN3O4c12632201392122(16(23)15(13)19)18710411(818)612(510)14(18)17(24)25h9121420H28H21H3(H2425)
MFCD06611426
ZINC000101309627
ZINC000245258121
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