Vitas-M small molecule compound
methyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK790974
SMILES COC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2cc(Cl)cc1)C#N)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 C16H12ClN3O4 MW 345.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O4/c1-7-12(14(21)23-2)16(10(6-18)13(19)24-7)9-5-8(17)3-4-11(9)20-15(16)22/h3-5H,19H2,1-2H3,(H,20,22)InChIKey
KTIHPZFGAFHEKL-UHFFFAOYSA-NSynonyms
313382-08-0313382080
CC1=C(C2(C3=C(C=CC(=C3)Cl)NC2=O)C(=C(O1)N)C#N)C(=O)OC
InChI=1SC16H12ClN3O4c1712(14(21)232)16(10(618)13(19)247)958(17)3411(9)2015(16)22h35H19H212H3(H2022)
methyl2amino5chloro3cyano6methyl2oxospiro(indoline34pyran)5carboxylate
methyl6amino5chloro5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
METHYL6AMINO5CHLORO5CYANO2METHYL2OXOSPIRO(1HINDOLE34PYRAN)3CARBOXYLATE
MFCD00747885
ZINC000000050646
ZINC000000050647
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Check stock on Vitas-MAvailable files
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