Vitas-M small molecule compound
{amino[1-cyano-2-(3-nitrophenyl)-4,6,8-trioxo-5,7-diazaspiro[2.5]oct-1-yl]methylidene}propanedinitrile
Catalog ID
STL434107
SMILES N#CC(=C(C1(C#N)C(C21C(=O)NC(=O)NC2=O)c1cccc(c1)[N+](=O)[O-])N)C#N
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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 C17H9N7O5 MW 391.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9N7O5/c18-5-9(6-19)12(21)16(7-20)11(8-2-1-3-10(4-8)24(28)29)17(16)13(25)22-15(27)23-14(17)26/h1-4,11H,21H2,(H2,22,23,25,26,27)InChIKey
IOSVNHSAHKWGOI-UHFFFAOYSA-NSynonyms
(amino(1cyano2(3nitrophenyl)468trioxo57diazaspiro(25)oct1yl)methylidene)propanedinitrile
2(amino(2cyano1(3nitrophenyl)468trioxo57diazaspiro(25)octan2yl)methylidene)propanedinitrile
C1=CC(=CC(=C1)(N+)(=O)(O))C2C(C23C(=O)NC(=O)NC3=O)(C#N)C(=C(C#N)C#N)N
InChI=1SC17H9N7O5c1859(619)12(21)16(720)11(821310(48)24(28)29)17(16)13(25)2215(27)2314(17)26h1411H21H2(H22223252627)
MFCD26098468
N#CC(=C(C1(C#N)C(C21C(=O)NC(=O)NC2=O)c1cccc(c1)(N+)(=O)(O))N)C#N
ZINC000085409154
ZINC000085409166
Check stock
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