Vitas-M small molecule compound
(2E)-1-(1-benzylpiperidin-4-yl)-5-(4-chlorophenyl)-N-nitro-1,3,5-triazinan-2-imine
Catalog ID
STK675129
SMILES Clc1ccc(cc1)N1CN/C(=N\[N+](=O)[O-])/N(C1)C1CCN(CC1)Cc1ccccc1
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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 C21H25ClN6O2 MW 428.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN6O2/c22-18-6-8-19(9-7-18)26-15-23-21(24-28(29)30)27(16-26)20-10-12-25(13-11-20)14-17-4-2-1-3-5-17/h1-9,20H,10-16H2,(H,23,24)InChIKey
OTFQOYGVKHDNFV-UHFFFAOYSA-NSynonyms
(2E)1(1benzylpiperidin4yl)5(4chlorophenyl)Nnitro135triazinan2imine
C1CN(CCC1N2CN(CN=C2N(N+)(=O)(O))C3=CC=C(C=C3)Cl)CC4=CC=CC=C4
Clc1ccc(cc1)N1CNC(=N(N+)(=O)(O))N(C1)C1CCN(CC1)Cc1ccccc1
InChI=1SC21H25ClN6O2c22186819(9718)26152321(2428(29)30)27(1626)20101225(131120)14174213517h1920H1016H2(H2324)
MFCD01572725
N(1(1BENZYLPIPERIDIN4YL)3(4CHLOROPHENYL)24DIHYDRO135TRIAZIN6YL)NITRAMIDE
ZINC000004398297
ZINC4398297
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