Vitas-M small molecule compound
2,2-dimethyl-1-(4-{4-nitro-3-[(tetrahydrofuran-2-ylmethyl)amino]phenyl}piperazin-1-yl)propan-1-one
Catalog ID
STK205958
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 C20H30N4O4 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N4O4/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/h6-7,13,16,21H,4-5,8-12,14H2,1-3H3InChIKey
AQAVSIABZAPDTG-UHFFFAOYSA-NSynonyms
22DIMETHYL1(4(4NITRO3((TETRAHYDROFURAN2YLMETHYL)AMINO)PHENYL)PIPERAZIN1YL)PROPAN1ONE
22DIMETHYL1(4(4NITRO3(OXOLAN2YLMETHYLAMINO)PHENYL)PIPERAZIN1YL)PROPAN1ONE
5(4(22DIMETHYLPROPANOYL)1PIPERAZINYL)2NITRON(TETRAHYDRO2FURANYLMETHYL)ANILINE
CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NCC3CCCO3
InChI=1SC20H30N4O4c120(23)19(25)2310822(91123)156718(24(26)27)17(1315)21141654122816h67131621H4581214H213H3
MFCD06167704
ZINC000004740929
ZINC000004740930
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