Vitas-M small molecule compound
furan-2-yl(4-{[3-(3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]carbonyl}piperazin-1-yl)methanone
Catalog ID
STK316597
SMILES O=C(C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccco1
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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 C22H26N6O5 MW 454.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O5/c29-18(17-2-1-7-33-17)25-3-5-26(6-4-25)19(30)21-9-15-8-16(10-21)12-22(11-15,13-21)27-14-23-20(24-27)28(31)32/h1-2,7,14-16H,3-6,8-13H2InChIKey
MXCTZZAQVVKSEC-UHFFFAOYSA-NSynonyms
444937-86-41(2FUROYL)4((3(3NITRO1H124TRIAZOL1YL)1ADAMANTYL)CARBONYL)PIPERAZINE
444937864
C1CN(CCN1C(=O)C2=CC=CO2)C(=O)C34CC5CC(C3)CC(C5)(C4)N6C=NC(=N6)(N+)(=O)(O)
furan2yl(4((3(3nitro1H124triazol1yl)tricyclo(3311~37~)dec1yl)carbonyl)piperazin1yl)methanone
FURAN2YL(4(3(3NITRO124TRIAZOL1YL)ADAMANTANE1CARBONYL)PIPERAZIN1YL)METHANONE
InChI=1SC22H26N6O5c2918(172173317)253526(6425)19(30)21915816(1021)1222(11151321)27142320(2427)28(31)32h1271416H36813H2
MFCD03071669
O=C(C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccco1
ZINC000018172617
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