Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(1,3-benzodioxol-5-ylcarbonyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL286841
SMILES O=C(C1N=NN(C1c1cccc(c1)[N+](=O)[O-])c1nonc1N)NNC(=O)c1ccc2c(c1)OCO2
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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 C19H15N9O7 MW 481.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N9O7/c20-16-17(25-35-24-16)27-15(9-2-1-3-11(6-9)28(31)32)14(21-26-27)19(30)23-22-18(29)10-4-5-12-13(7-10)34-8-33-12/h1-7,14-15H,8H2,(H2,20,24)(H,22,29)(H,23,30)InChIKey
HNECDJKNFJTEGW-UHFFFAOYSA-NSynonyms
1(4amino125oxadiazol3yl)N(13benzodioxol5ylcarbonyl)5(3nitrophenyl)45dihydro1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N(13benzodioxole5carbonyl)5(3nitrophenyl)45dihydrotriazole4carbohydrazide
C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3C(N(N=N3)C4=NON=C4N)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC19H15N9O7c201617(25352416)2715(921311(69)28(31)32)14(212627)19(30)232218(29)10451213(710)3483312h171415H8H2(H22024)(H2229)(H2330)
MFCD02763741
O=C(C1N=NN(C1c1cccc(c1)(N+)(=O)(O))c1nonc1N)NNC(=O)c1ccc2c(c1)OCO2
ZINC000095481744
ZINC000095481747
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