Vitas-M small molecule compound
6-amino-3-tert-butyl-4-(4-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK761644
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)[N+](=O)[O-])c(n[nH]2)C(C)(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 C17H17N5O3 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3/c1-17(2,3)14-13-12(9-4-6-10(7-5-9)22(23)24)11(8-18)15(19)25-16(13)21-20-14/h4-7,12H,19H2,1-3H3,(H,20,21)InChIKey
LIBORKCFNIZDRJ-UHFFFAOYSA-NSynonyms
6amino3tertbutyl4(4nitrophenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3TERTBUTYL4(4NITROPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H17N5O3c117(23)141312(94610(759)22(23)24)11(818)15(19)2516(13)212014h4712H19H213H3(H2021)
MFCD01926197
N#CC1=C(N)Oc2c(C1c1ccc(cc1)(N+)(=O)(O))c(n(nH)2)C(C)(C)C
ZINC000005095383
ZINC000005095384
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