Vitas-M small molecule compound
1-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK242184
SMILES C=CCn1c(SCC(=O)c2cc(n(c2C)c2ccc(cc2)F)C)nnc1c1ccncc1
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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 C24H22FN5OS MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5OS/c1-4-13-29-23(18-9-11-26-12-10-18)27-28-24(29)32-15-22(31)21-14-16(2)30(17(21)3)20-7-5-19(25)6-8-20/h4-12,14H,1,13,15H2,2-3H3InChIKey
IPYARAGDSRHVSO-UHFFFAOYSA-NSynonyms
1(1(4fluorophenyl)25dimethyl1Hpyrrol3yl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(1(4fluorophenyl)25dimethylpyrrol3yl)2((4prop2enyl5pyridin4yl124triazol3yl)sulfanyl)ethanone
CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)CSC3=NN=C(N3CC=C)C4=CC=NC=C4
InChI=1SC24H22FN5OSc14132923(1891126121018)272824(29)321522(31)211416(2)30(17(21)3)207519(25)6820h41214H11315H223H3
MFCD04759962
ZINC000009192504
ZINC09192504
ZINC9192504
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