Vitas-M small molecule compound
2-amino-1'-(3-fluorobenzyl)-2',5-dioxo-1-[3-(trifluoromethyl)phenyl]-1',2',5,7-tetrahydro-1H-spiro[furo[3,4-b]pyridine-4,3'-indole]-3-carbonitrile
Catalog ID
STK686750
SMILES N#CC1=C(N)N(c2cccc(c2)C(F)(F)F)C2=C(C31C(=O)N(c1c3cccc1)Cc1cccc(c1)F)C(=O)OC2
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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 C29H18F4N4O3 MW 546.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18F4N4O3/c30-18-7-3-5-16(11-18)14-36-22-10-2-1-9-20(22)28(27(36)39)21(13-34)25(35)37(23-15-40-26(38)24(23)28)19-8-4-6-17(12-19)29(31,32)33/h1-12H,14-15,35H2InChIKey
XNSFILINFWIFFM-UHFFFAOYSA-NSynonyms
2AMINO1((3FLUOROPHENYL)METHYL)25DIOXO1(3(TRIFLUOROMETHYL)PHENYL)SPIRO(7HFURO(34B)PYRIDINE43INDOLE)3CARBONITRILE
2amino1(3fluorobenzyl)25dioxo1(3(trifluoromethyl)phenyl)1257tetrahydro1Hspiro(furo(34b)pyridine43indole)3carbonitrile
C1C2=C(C(=O)O1)C3(C4=CC=CC=C4N(C3=O)CC5=CC(=CC=C5)F)C(=C(N2C6=CC=CC(=C6)C(F)(F)F)N)C#N
InChI=1SC29H18F4N4O3c301873516(1118)1436221021920(22)28(27(36)39)21(1334)25(35)37(23154026(38)24(23)28)1984617(1219)29(3132)33h112H141535H2
MFCD06017415
ZINC000098008057
ZINC000098008058
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