Vitas-M small molecule compound
4-nitro-5-({1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}amino)benzene-1,2-dicarbonitrile
Catalog ID
STK685548
SMILES CC(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)Nc1cc(C#N)c(cc1[N+](=O)[O-])C#N
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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 C20H22N4O2 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2/c1-12(20-7-13-2-14(8-20)4-15(3-13)9-20)23-18-5-16(10-21)17(11-22)6-19(18)24(25)26/h5-6,12-15,23H,2-4,7-9H2,1H3/t12?,13-,14+,15-,20?InChIKey
SSCRIPTVQFSGHN-UOBONFSKSA-NSynonyms
4nitro5((1((3s5s7s)tricyclo(3311~37~)dec1yl)ethyl)amino)benzene12dicarbonitrileCC(C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)Nc1cc(C#N)c(cc1(N+)(=O)(O))C#N
Registry IDs
MFCD05859501ZINC000004593562
ZINC000004593563
Check stock
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Check stock on Vitas-MAvailable files
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