Vitas-M small molecule compound
dipropan-2-yl 5-{[(4-nitro-1H-pyrazol-1-yl)acetyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK956386
SMILES O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1cc(cc(c1)C(=O)OC(C)C)C(=O)OC(C)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 C19H22N4O7 MW 418.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O7/c1-11(2)29-18(25)13-5-14(19(26)30-12(3)4)7-15(6-13)21-17(24)10-22-9-16(8-20-22)23(27)28/h5-9,11-12H,10H2,1-4H3,(H,21,24)InChIKey
OYBDHJWWRRPIPH-UHFFFAOYSA-NSynonyms
512814-05-0512814050
CC(C)OC(=O)C1=CC(=CC(=C1)NC(=O)CN2C=C(C=N2)(N+)(=O)(O))C(=O)OC(C)C
DIISOPROPYL5(((4NITRO1HPYRAZOL1YL)ACETYL)AMINO)ISOPHTHALATE
dipropan2yl5(((4nitro1Hpyrazol1yl)acetyl)amino)benzene13dicarboxylate
DIPROPAN2YL5((2(4NITROPYRAZOL1YL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC19H22N4O7c111(2)2918(25)13514(19(26)3012(3)4)715(613)2117(24)1022916(82022)23(27)28h591112H10H214H3(H2124)
MFCD03466826
O=C(Cn1ncc(c1)(N+)(=O)(O))Nc1cc(cc(c1)C(=O)OC(C)C)C(=O)OC(C)C
ZINC000000651327
ZINC00651327
ZINC651327
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