Vitas-M small molecule compound
1'-(3-fluorophenyl)-1,7',7'-trimethyl-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
STK782319
SMILES N#CC1=C(n2cccc2)N(c2cccc(c2)F)C2=C(C31C(=O)N(c1c3cccc1)C)C(=O)CC(C2)(C)C
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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 C30H25FN4O2 MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25FN4O2/c1-29(2)16-24-26(25(36)17-29)30(21-11-4-5-12-23(21)33(3)28(30)37)22(18-32)27(34-13-6-7-14-34)35(24)20-10-8-9-19(31)15-20/h4-15H,16-17H2,1-3H3InChIKey
BSZFXUSHBVEHEO-UHFFFAOYSA-NSynonyms
1(3fluorophenyl)177trimethyl25dioxo2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1(3FLUOROPHENYL)177TRIMETHYL25DIOXO2PYRROL1YLSPIRO(68DIHYDROQUINOLINE43INDOLE)3CARBONITRILE
CC1(CC2=C(C(=O)C1)C3(C4=CC=CC=C4N(C3=O)C)C(=C(N2C5=CC(=CC=C5)F)N6C=CC=C6)C#N)C
InChI=1SC30H25FN4O2c129(2)162426(25(36)1729)30(2111451223(21)33(3)28(30)37)22(1832)27(3413671434)35(24)20108919(31)1520h415H1617H213H3
MFCD06017402
ZINC000012402246
ZINC000012402247
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