Vitas-M small molecule compound
1'-ethyl-5-(4-iodophenyl)-3'-methyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole
Catalog ID
STL390678
SMILES CCn1nc(c(c1)C1CC(=NN1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)I)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 C21H20IN5O2 MW 501.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20IN5O2/c1-3-25-13-19(14(2)23-25)21-12-20(15-4-6-16(22)7-5-15)24-26(21)17-8-10-18(11-9-17)27(28)29/h4-11,13,21H,3,12H2,1-2H3InChIKey
LJSBXHZYSFGTPC-UHFFFAOYSA-NSynonyms
1ETHYL4(5(4IODOPHENYL)2(4NITROPHENYL)34DIHYDROPYRAZOL3YL)3METHYLPYRAZOLE
1ethyl5(4iodophenyl)3methyl2(4nitrophenyl)34dihydro1H2H34bipyrazole
CCN1C=C(C(=N1)C)C2CC(=NN2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=C(C=C4)I
CCn1nc(c(c1)C1CC(=NN1c1ccc(cc1)(N+)(=O)(O))c1ccc(cc1)I)C
InChI=1SC21H20IN5O2c13251319(14(2)2325)211220(154616(22)7515)2426(21)1781018(11917)27(28)29h4111321H312H212H3
MFCD04050212
ZINC000020602369
ZINC000020602370
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