Vitas-M small molecule compound
1-ethyl-1'-(4-fluorophenyl)-7',7'-dimethyl-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK783054
SMILES CCN1c2ccccc2C2(C1=O)C1=C(CC(CC1=O)(C)C)N(C(=C2C#N)n1cccc1)c1ccc(cc1)F
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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 C31H27FN4O2 MW 506.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27FN4O2/c1-4-35-24-10-6-5-9-22(24)31(29(35)38)23(19-33)28(34-15-7-8-16-34)36(21-13-11-20(32)12-14-21)25-17-30(2,3)18-26(37)27(25)31/h5-16H,4,17-18H2,1-3H3InChIKey
PYAAVBXUGSZDFM-UHFFFAOYSA-NSynonyms
1ethyl1(4fluorophenyl)77dimethyl25dioxo2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1ETHYL1(4FLUOROPHENYL)77DIMETHYL25DIOXO2PYRROL1YLSPIRO(68DIHYDROQUINOLINE43INDOLE)3CARBONITRILE
CCN1C2=CC=CC=C2C3(C1=O)C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC=C(C=C5)F)N6C=CC=C6)C#N
InChI=1SC31H27FN4O2c1435241065922(24)31(29(35)38)23(1933)28(3415781634)36(21131120(32)121421)251730(23)1826(37)27(25)31h516H41718H213H3
MFCD06617436
ZINC000012412000
ZINC000012412002
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