Vitas-M small molecule compound

2-{[4-ethyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone

Catalog ID
STL364545
SMILES CCn1c(SCC(=O)c2cc(n(c2C)c2ccc(cc2)F)C)nnc1CN1CCOCC1

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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 C23H28FN5O2S MW 457.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28FN5O2S/c1-4-28-22(14-27-9-11-31-12-10-27)25-26-23(28)32-15-21(30)20-13-16(2)29(17(20)3)19-7-5-18(24)6-8-19/h5-8,13H,4,9-12,14-15H2,1-3H3
InChIKey
SYXNNTSPYCWDHY-UHFFFAOYSA-N
Synonyms

2((4ethyl5(morpholin4ylmethyl)124triazol3yl)sulfanyl)1(1(4fluorophenyl)25dimethylpyrrol3yl)ethanone
2((4ethyl5(morpholin4ylmethyl)4H124triazol3yl)sulfanyl)1(1(4fluorophenyl)25dimethyl1Hpyrrol3yl)ethanone
CCN1C(=NN=C1SCC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C)CN4CCOCC4
InChI=1SC23H28FN5O2Sc142822(142791131121027)252623(28)321521(30)201316(2)29(17(20)3)197518(24)6819h5813H49121415H213H3
MFCD09476494
ZINC000015019294
ZINC15019294

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Available files

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