Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-N-(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine
Catalog ID
STK844418
SMILES [O-][N+](=O)c1c(N)nc(nc1NCc1ccco1)N1CCN(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 C20H23N7O3 MW 409.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O3/c21-18-17(27(28)29)19(22-13-16-7-4-12-30-16)24-20(23-18)26-10-8-25(9-11-26)14-15-5-2-1-3-6-15/h1-7,12H,8-11,13-14H2,(H3,21,22,23,24)InChIKey
OOTGNSZYZSBPBO-UHFFFAOYSA-NSynonyms
836639-43-1(6AMINO5NITRO2(4BENZYLPIPERAZINYL)PYRIMIDIN4YL)(2FURYLMETHYL)AMINE
2(4BENZYLPIPERAZIN1YL)4N(FURAN2YLMETHYL)5NITROPYRIMIDINE46DIAMINE
2(4benzylpiperazin1yl)N(furan2ylmethyl)5nitropyrimidine46diamine
2(4benzylpiperazin1yl)N4(furan2ylmethyl)5nitropyrimidine46diamine
836639431
C1CN(CCN1CC2=CC=CC=C2)C3=NC(=C(C(=N3)NCC4=CC=CO4)(N+)(=O)(O))N
InChI=1SC20H23N7O3c211817(27(28)29)19(22131674123016)2420(2318)2610825(91126)14155213615h1712H8111314H2(H321222324)
MFCD03690309
ZINC000020229863
ZINC20229863
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