Vitas-M small molecule compound
1-(4-fluorobenzyl)-2,5'-dioxo-1'-phenyl-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK687776
SMILES N#CC1=C(n2cccc2)N(c2ccccc2)C2=C(C31C(=O)N(c1c3cccc1)Cc1ccc(cc1)F)C(=O)CCC2
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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 C34H25FN4O2 MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25FN4O2/c35-24-17-15-23(16-18-24)22-38-28-12-5-4-11-26(28)34(33(38)41)27(21-36)32(37-19-6-7-20-37)39(25-9-2-1-3-10-25)29-13-8-14-30(40)31(29)34/h1-7,9-12,15-20H,8,13-14,22H2InChIKey
KSXOFFMQAVIWLD-UHFFFAOYSA-NSynonyms
1((4FLUOROPHENYL)METHYL)25DIOXO1PHENYL2PYRROL1YLSPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
1(4fluorobenzyl)25dioxo1phenyl2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
C1CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)F)C(=C(N2C6=CC=CC=C6)N7C=CC=C7)C#N
InChI=1SC34H25FN4O2c3524171523(161824)22382812541126(28)34(33(38)41)27(2136)32(3719672037)39(2592131025)291381430(40)31(29)34h179121520H8131422H2
MFCD07021724
ZINC000098008441
ZINC000098008442
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