Vitas-M small molecule compound

(5Z)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile

Catalog ID
STK514693
SMILES OCCCN1C(=O)/C(=C\c2ccc(o2)c2ccc(cc2)F)/C(=C(C1=O)C#N)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 C21H17FN2O4 MW 380.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O4/c1-13-17(20(26)24(9-2-10-25)21(27)18(13)12-23)11-16-7-8-19(28-16)14-3-5-15(22)6-4-14/h3-8,11,25H,2,9-10H2,1H3/b17-11-
InChIKey
RNZTUPFHYACMNT-BOPFTXTBSA-N
Synonyms

(5Z)5((5(4fluorophenyl)furan2yl)methylidene)1(3hydroxypropyl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)5((5(4fluorophenyl)furan2yl)methylidene)1(3hydroxypropyl)4methyl26dioxopyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CC2=CC=C(O2)C3=CC=C(C=C3)F)CCCO)C#N
InChI=1SC21H17FN2O4c11317(20(26)24(921025)21(27)18(13)1223)11167819(2816)143515(22)6414h381125H2910H21H3b1711
MFCD06644953
OCCCN1C(=O)C(=Cc2ccc(o2)c2ccc(cc2)F)C(=C(C1=O)C#N)C
ZINC000016741456
ZINC16741456

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Available files

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