Vitas-M small molecule compound
1-(4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)-2,2-dimethylpropan-1-one
Catalog ID
STK063117
SMILES O=C(C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[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 C20H26N4O4 MW 386.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O4/c1-20(2,3)19(25)23-10-8-22(9-11-23)15-6-7-18(24(26)27)17(13-15)21-14-16-5-4-12-28-16/h4-7,12-13,21H,8-11,14H2,1-3H3InChIKey
STOOPEWCLPGFQD-UHFFFAOYSA-NSynonyms
1(4(3((FURAN2YLMETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE
1(4(3(FURAN2YLMETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE
CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CO3
InChI=1SC20H26N4O4c120(23)19(25)2310822(91123)156718(24(26)27)17(1315)21141654122816h47121321H81114H213H3
MFCD03031397
O=C(C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)(N+)(=O)(O)
STK063117
ZINC000004575576
ZINC04575576
ZINC4575576
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