Vitas-M small molecule compound
(2Z)-2-[(3-methylphenyl)imino]-6-(4-methylpiperazin-1-yl)-5-nitro-1,2-dihydropyrimidin-4-amine
Catalog ID
STL049976
SMILES CN1CCN(CC1)c1[nH]/c(=N/c2cccc(c2)C)/nc(c1[N+](=O)[O-])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 C16H21N7O2 MW 343.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N7O2/c1-11-4-3-5-12(10-11)18-16-19-14(17)13(23(24)25)15(20-16)22-8-6-21(2)7-9-22/h3-5,10H,6-9H2,1-2H3,(H3,17,18,19,20)InChIKey
NYMHUCYCTSTYJX-UHFFFAOYSA-NSynonyms
714946-00-6(2Z)2((3methylphenyl)imino)6(4methylpiperazin1yl)5nitro12dihydropyrimidin4amine
2N(3METHYLPHENYL)6(4METHYLPIPERAZIN1YL)5NITROPYRIMIDINE24DIAMINE
6(4METHYLPIPERAZIN1YL)5NITRON2MTOLYLPYRIMIDINE24DIAMINE
714946006
CC1=CC(=CC=C1)NC2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCN(CC3)C
CN1CCN(CC1)c1(nH)c(=Nc2cccc(c2)C)nc(c1(N+)(=O)(O))N
InChI=1SC16H21N7O2c11143512(1011)18161914(17)13(23(24)25)15(2016)228621(2)7922h3510H69H212H3(H317181920)
MFCD05737193
ZINC000005219395
ZINC5219395
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