Vitas-M small molecule compound
6'-amino-5-chloro-3'-(4-nitrophenyl)-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK568711
SMILES N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(Cl)cc1)c([nH]n2)c1ccc(cc1)[N+](=O)[O-]
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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 C20H11ClN6O4 MW 434.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H11ClN6O4/c21-10-3-6-14-12(7-10)20(19(28)24-14)13(8-22)17(23)31-18-15(20)16(25-26-18)9-1-4-11(5-2-9)27(29)30/h1-7H,23H2,(H,24,28)(H,25,26)InChIKey
BXHZAUHIXZGGKE-UHFFFAOYSA-NSynonyms
847162-42-96amino5chloro3(4nitrophenyl)2oxo12dihydro2Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6amino5chloro3(4nitrophenyl)2oxo1Hspiro(indoline34pyrano(23c)pyrazole)5carbonitrile
6AMINO5CHLORO3(4NITROPHENYL)2OXOSPIRO(1HINDOLE342HPYRANO(23C)PYRAZOLE)5CARBONITRILE
847162429
C1=CC(=CC=C1C2=C3C(=NN2)OC(=C(C34C5=C(C=CC(=C5)Cl)NC4=O)C#N)N)(N+)(=O)(O)
InChI=1SC20H11ClN6O4c2110361412(710)20(19(28)2414)13(822)17(23)311815(20)16(252618)91411(529)27(29)30h17H23H2(H2428)(H2526)
MFCD05737005
N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(Cl)cc1)c((nH)n2)c1ccc(cc1)(N+)(=O)(O)
N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(Cl)cc1)c(n(nH)2)c1ccc(cc1)(N+)(=O)(O)
ZINC000009159529
ZINC000009160254
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.