Vitas-M small molecule compound

methyl [6'-amino-1-(4-chlorobenzyl)-5'-cyano-2-oxo-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl]acetate

Catalog ID
STL055021
SMILES COC(=O)Cc1[nH]nc2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)Cc1ccc(cc1)Cl

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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 C24H18ClN5O4 MW 475.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN5O4/c1-33-19(31)10-17-20-22(29-28-17)34-21(27)16(11-26)24(20)15-4-2-3-5-18(15)30(23(24)32)12-13-6-8-14(25)9-7-13/h2-9H,10,12,27H2,1H3,(H,28,29)
InChIKey
RMXGRJAGXORPKK-UHFFFAOYSA-N
Synonyms
674807-67-1
674807671
COC(=O)Cc1(nH)nc2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)Cc1ccc(cc1)Cl
COC(=O)CC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)Cl)C#N)N
COC(=O)Cc1n(nH)c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)Cc1ccc(cc1)Cl
InChI=1SC24H18ClN5O4c13319(31)10172022(292817)3421(27)16(1126)24(20)15423518(15)30(23(24)32)12136814(25)9713h29H101227H21H3(H2829)
methyl(6amino1(4chlorobenzyl)5cyano2oxo12dihydro2Hspiro(indole34pyrano(23c)pyrazol)3yl)acetate
METHYL2(6AMINO1((4CHLOROPHENYL)METHYL)5CYANO2OXOSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)3YL)ACETATE
methyl2(6amino1(4chlorobenzyl)5cyano2oxo1Hspiro(indoline34pyrano(23c)pyrazol)3yl)acetate
MFCD05730512
ZINC000006498946
ZINC000006498947

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Available files

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