Vitas-M small molecule compound

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

Catalog ID
STL041914
SMILES N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1ccc(c(c1)Cl)Cl)c(C)[nH]n2

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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 C22H15Cl2N5O2 MW 452.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2N5O2/c1-11-18-20(28-27-11)31-19(26)14(9-25)22(18)13-4-2-3-5-17(13)29(21(22)30)10-12-6-7-15(23)16(24)8-12/h2-8H,10,26H2,1H3,(H,27,28)
InChIKey
RQOWXSPBTVSVLQ-UHFFFAOYSA-N
Synonyms
843635-43-8
6AMINO1((34DICHLOROPHENYL)METHYL)3METHYL2OXOSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBONITRILE
6amino1(34dichlorobenzyl)3methyl2oxo12dihydro2Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6amino1(34dichlorobenzyl)3methyl2oxo1Hspiro(indoline34pyrano(23c)pyrazole)5carbonitrile
843635438
CC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4N(C3=O)CC5=CC(=C(C=C5)Cl)Cl)C#N)N
InChI=1SC22H15Cl2N5O2c1111820(282711)3119(26)14(925)22(18)13423517(13)29(21(22)30)10126715(23)16(24)812h28H1026H21H3(H2728)
MFCD05733546
N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1ccc(c(c1)Cl)Cl)c(C)(nH)n2
N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1ccc(c(c1)Cl)Cl)c(C)n(nH)2
ZINC000009191714
ZINC000009191715

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Available files

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