Vitas-M small molecule compound
(5Z)-1-benzyl-5-{1-[(4-methylpiperazin-4-ium-1-yl)amino]ethylidene}-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL055567
SMILES C[NH+]1CCN(CC1)N/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/C
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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 C18H23N5O3 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O3/c1-13(20-22-10-8-21(2)9-11-22)15-16(24)19-18(26)23(17(15)25)12-14-6-4-3-5-7-14/h3-7,20H,8-12H2,1-2H3,(H,19,24,26)/b15-13-InChIKey
OPBZQXQMKHWNNS-SQFISAMPSA-NSynonyms
(5Z)1BENZYL5(1((4METHYLPIPERAZIN1YL)AMINO)ETHYLIDENE)13DIAZINANE246TRIONE
(5Z)1benzyl5(1((4methylpiperazin4ium1yl)amino)ethylidene)26dioxo1256tetrahydropyrimidin4olate
(5Z)1BENZYL5(1((4METHYLPIPERAZIN4IUM1YL)AMINO)ETHYLIDENE)46DIOXOPYRIMIDIN2OLATE
1BENZYL5(1(4METHYLPIPERAZIN1YLAMINO)ETH(Z)YLIDENE)PYRIMIDINE246TRIONE
C(NH+)1CCN(CC1)NC(=C1C(=NC(=O)N(C1=O)Cc1ccccc1)(O))C
CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NN3CCN(CC3)C
InChI=1SC18H23N5O3c113(202210821(2)91122)1516(24)1918(26)23(17(15)25)12146435714h3720H812H212H3(H192426)b1513
MFCD18249687
ZINC000020290885
ZINC20290885
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