Vitas-M small molecule compound
(2Z)-6-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethylphenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine
Catalog ID
STL048671
SMILES [O-][N+](=O)c1c(N)n/c(=N\c2ccc(c(c2)C)C)/[nH]c1N1CCN(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 C23H27N7O2 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N7O2/c1-16-8-9-19(14-17(16)2)25-23-26-21(24)20(30(31)32)22(27-23)29-12-10-28(11-13-29)15-18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3,(H3,24,25,26,27)InChIKey
OLXADRKCIAIKLU-UHFFFAOYSA-NSynonyms
713126-60-4(2Z)6(4benzylpiperazin1yl)2((34dimethylphenyl)imino)5nitro12dihydropyrimidin4amine
(4AMINO5NITRO6(4BENZYLPIPERAZINYL)PYRIMIDIN2YL)(34DIMETHYLPHENYL)AMINE
(O)(N+)(=O)c1c(N)nc(=Nc2ccc(c(c2)C)C)(nH)c1N1CCN(CC1)Cc1ccccc1
6(4BENZYLPIPERAZIN1YL)2N(34DIMETHYLPHENYL)5NITROPYRIMIDINE24DIAMINE
713126604
CC1=C(C=C(C=C1)NC2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCN(CC3)CC4=CC=CC=C4)C
InChI=1SC23H27N7O2c1168919(1417(16)2)25232621(24)20(30(31)32)22(2723)29121028(111329)15186435718h3914H101315H212H3(H324252627)
MFCD05726892
ZINC000017207474
ZINC17207474
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