Vitas-M small molecule compound
methyl 6'-amino-5'-cyano-1-(3-fluorobenzyl)-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK783048
SMILES COC(=O)C1=C(C)OC(=C(C21C(=O)N(c1c2cccc1)Cc1cccc(c1)F)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 C23H18FN3O4 MW 419.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FN3O4/c1-13-19(21(28)30-2)23(17(11-25)20(26)31-13)16-8-3-4-9-18(16)27(22(23)29)12-14-6-5-7-15(24)10-14/h3-10H,12,26H2,1-2H3InChIKey
LSRXZMONNZSMSG-UHFFFAOYSA-NSynonyms
CC1=C(C2(C3=CC=CC=C3N(C2=O)CC4=CC(=CC=C4)F)C(=C(O1)N)C#N)C(=O)OC
InChI=1SC23H18FN3O4c11319(21(28)302)23(17(1125)20(26)3113)16834918(16)27(22(23)29)121465715(24)1014h310H1226H212H3
METHYL6AMINO5CYANO1((3FLUOROPHENYL)METHYL)2METHYL2OXOSPIRO(INDOLE34PYRAN)3CARBOXYLATE
methyl6amino5cyano1(3fluorobenzyl)2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
MFCD06617429
ZINC000012416707
ZINC000012416709
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