Vitas-M small molecule compound
6'-amino-4-bromo-3'-(4-ethoxyphenyl)-5-methyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK765538
SMILES CCOc1ccc(cc1)c1n[nH]c2c1C1(C(=O)Nc3c1c(Br)c(cc3)C)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 C23H18BrN5O3 MW 492.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN5O3/c1-3-31-13-7-5-12(6-8-13)19-17-21(29-28-19)32-20(26)14(10-25)23(17)16-15(27-22(23)30)9-4-11(2)18(16)24/h4-9H,3,26H2,1-2H3,(H,27,30)(H,28,29)InChIKey
URTDOPKQGOLJPW-UHFFFAOYSA-NSynonyms
6amino4bromo3(4ethoxyphenyl)5methyl2oxo12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6AMINO4BROMO3(4ETHOXYPHENYL)5METHYL2OXOSPIRO(1HINDOLE342HPYRANO(23C)PYRAZOLE)5CARBONITRILE
CCOC1=CC=C(C=C1)C2=C3C(=NN2)OC(=C(C34C5=C(C=CC(=C5Br)C)NC4=O)C#N)N
CCOc1ccc(cc1)c1n(nH)c2c1C1(C(=O)Nc3c1c(Br)c(cc3)C)C(=C(O2)N)C#N
InChI=1SC23H18BrN5O3c1331137512(6813)191721(292819)3220(26)14(1025)23(17)1615(2722(23)30)9411(2)18(16)24h49H326H212H3(H2730)(H2829)
MFCD03035655
ZINC000004166882
ZINC000004166892
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