Vitas-M small molecule compound
(2Z)-6-(4-benzylpiperazin-1-yl)-2-[(4-methylphenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine
Catalog ID
STL051724
SMILES Cc1ccc(cc1)/N=c/1\nc(N)c(c([nH]1)N1CCN(CC1)Cc1ccccc1)[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 C22H25N7O2 MW 419.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N7O2/c1-16-7-9-18(10-8-16)24-22-25-20(23)19(29(30)31)21(26-22)28-13-11-27(12-14-28)15-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H3,23,24,25,26)InChIKey
ZCGITIOGNKNSSQ-UHFFFAOYSA-NSynonyms
714928-57-1(2Z)6(4benzylpiperazin1yl)2((4methylphenyl)imino)5nitro12dihydropyrimidin4amine
6(4BENZYLPIPERAZIN1YL)2N(4METHYLPHENYL)5NITROPYRIMIDINE24DIAMINE
6(4BENZYLPIPERAZIN1YL)N2(4METHYLPHENYL)5NITROPYRIMIDINE24DIAMINE
714928571
CC1=CC=C(C=C1)NC2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCN(CC3)CC4=CC=CC=C4
Cc1ccc(cc1)N=c1nc(N)c(c((nH)1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC22H25N7O2c1167918(10816)24222520(23)19(29(30)31)21(2622)28131127(121428)15175324617h210H1115H21H3(H323242526)
MFCD05734398
ZINC000005163996
ZINC5163996
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