Vitas-M small molecule compound

6'-amino-3'-methyl-5-nitro-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile

Catalog ID
STL056281
SMILES N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(cc1)[N+](=O)[O-])c(C)nn2c1ccccc1

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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 C21H14N6O4 MW 414.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N6O4/c1-11-17-19(26(25-11)12-5-3-2-4-6-12)31-18(23)15(10-22)21(17)14-9-13(27(29)30)7-8-16(14)24-20(21)28/h2-9H,23H2,1H3,(H,24,28)
InChIKey
NHJZQHICYBEZPX-UHFFFAOYSA-N
Synonyms
654069-76-8
1PHENYL2OXO3METHYL5NITRO6AMINOSPIRO(PYRANO(23C)PYRAZOLE4(1H)3INDOLINE)5CARBONITRILE
654069768
6amino3methyl5nitro2oxo1phenyl12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6amino3methyl5nitro2oxo1phenyl1Hspiro(indoline34pyrano(23c)pyrazole)5carbonitrile
6AMINO3METHYL5NITRO2OXO1PHENYLSPIRO(1HINDOLE34PYRANO(23C)PYRAZOLE)5CARBONITRILE
CC1=NN(C2=C1C3(C4=C(C=CC(=C4)(N+)(=O)(O))NC3=O)C(=C(O2)N)C#N)C5=CC=CC=C5
InChI=1SC21H14N6O4c1111719(26(2511)125324612)3118(23)15(1022)21(17)14913(27(29)30)7816(14)2420(21)28h29H23H21H3(H2428)
MFCD04182867
N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(cc1)(N+)(=O)(O))c(C)nn2c1ccccc1
ZINC000009159487
ZINC000009159488

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Available files

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