Vitas-M small molecule compound
ethyl (6'-amino-5'-cyano-5-nitro-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl)acetate
Catalog ID
STK568676
SMILES CCOC(=O)Cc1[nH]nc2c1C1(C(=O)Nc3c1cc(cc3)[N+](=O)[O-])C(=C(O2)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 C18H14N6O6 MW 410.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N6O6/c1-2-29-13(25)6-12-14-16(23-22-12)30-15(20)10(7-19)18(14)9-5-8(24(27)28)3-4-11(9)21-17(18)26/h3-5H,2,6,20H2,1H3,(H,21,26)(H,22,23)InChIKey
HPBKCHCFAOUACO-UHFFFAOYSA-NSynonyms
674807-40-0674807400
CCOC(=O)Cc1(nH)nc2c1C1(C(=O)Nc3c1cc(cc3)(N+)(=O)(O))C(=C(O2)N)C#N
CCOC(=O)CC1=C2C(=NN1)OC(=C(C23C4=C(C=CC(=C4)(N+)(=O)(O))NC3=O)C#N)N
CCOC(=O)Cc1n(nH)c2c1C1(C(=O)Nc3c1cc(cc3)(N+)(=O)(O))C(=C(O2)N)C#N
ethyl(6amino5cyano5nitro2oxo12dihydro2Hspiro(indole34pyrano(23c)pyrazol)3yl)acetate
ethyl2(6amino5cyano5nitro2oxo1Hspiro(indoline34pyrano(23c)pyrazol)3yl)acetate
ETHYL2(6AMINO5CYANO5NITRO2OXOSPIRO(1HINDOLE342HPYRANO(23C)PYRAZOLE)3YL)ACETATE
InChI=1SC18H14N6O6c122913(25)6121416(232212)3015(20)10(719)18(14)958(24(27)28)3411(9)2117(18)26h35H2620H21H3(H2126)(H2223)
MFCD05724855
ZINC000009242507
ZINC000009242508
Check stock
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Check stock on Vitas-MAvailable files
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