Vitas-M small molecule compound
5-(3,5-dimethylpiperazin-1-yl)-2-nitro-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]aniline
Catalog ID
STK036449
SMILES CC1NC(C)CN(C1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)[N+](=O)[O-]
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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 C24H36N4O2 MW 412.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H36N4O2/c1-15-13-27(14-16(2)25-15)21-4-5-23(28(29)30)22(9-21)26-17(3)24-10-18-6-19(11-24)8-20(7-18)12-24/h4-5,9,15-20,25-26H,6-8,10-14H2,1-3H3InChIKey
KWHRYUWXQQAQKL-UHFFFAOYSA-NSynonyms
(1ADAMANTAN1YLETHYL)(5(35DIMETHYLPIPERAZIN1YL)2NITROPHENYL)AMINE
5(35dimethylpiperazin1yl)2nitroN(1(tricyclo(3311~37~)dec1yl)ethyl)aniline
CC1CN(CC(N1)C)C2=CC(=C(C=C2)(N+)(=O)(O))NC(C)C34CC5CC(C3)CC(C5)C4
CC1NC(C)CN(C1)c1ccc(c(c1)NC(C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)C)(N+)(=O)(O)
CC1NC(C)CN(C1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)(N+)(=O)(O)
InChI=1SC24H36N4O2c1151327(1416(2)2515)214523(28(29)30)22(921)2617(3)241018619(1124)820(718)1224h45915202526H681014H213H3
MFCD01826630
N(1((3r5r7r)adamantan1yl)ethyl)5(35dimethylpiperazin1yl)2nitroaniline
N(1(1ADAMANTYL)ETHYL)5(35DIMETHYLPIPERAZIN1YL)2NITROANILINE
STK036449
ZINC000004143249
ZINC000013361695
Check stock
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Check stock on Vitas-MAvailable files
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