Vitas-M small molecule compound

N-(3-chloro-4-fluorophenyl)-2-{[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL341178
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nc2c(c1=O)c(C)c(s2)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 C19H17ClFN3O2S2 MW 437.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClFN3O2S2/c1-4-7-24-18(26)16-10(2)11(3)28-17(16)23-19(24)27-9-15(25)22-12-5-6-14(21)13(20)8-12/h4-6,8H,1,7,9H2,2-3H3,(H,22,25)
InChIKey
USUMYMQWAWUMSA-UHFFFAOYSA-N
Synonyms
679804-64-9
2((3allyl56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)thio)N(3chloro4fluorophenyl)acetamide
2(56DIMETHYL4OXO3PROP2ENYL(3HYDROTHIOPHENO(23D)PYRIMIDIN2YLTHIO))N(3CHLORO4FLUOROPHENYL)ACETAMIDE
679804649
CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC(=C(C=C3)F)Cl)CC=C)C
InChI=1SC19H17ClFN3O2S2c1472418(26)1610(2)11(3)2817(16)2319(24)27915(25)22125614(21)13(20)812h468H179H223H3(H2225)
MFCD04025383
N(3chloro4fluorophenyl)2((56dimethyl4oxo3(prop2en1yl)34dihydrothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(3CHLORO4FLUOROPHENYL)2((56DIMETHYL4OXO3(PROP2EN1YL)3H4HTHIENO(23D)PYRIMIDIN2YL)SULFANYL)ACETAMIDE
N(3CHLORO4FLUOROPHENYL)2(56DIMETHYL4OXO3PROP2ENYLTHIENO(23D)PYRIMIDIN2YL)SULFANYLACETAMIDE
ZINC000002372127
ZINC02372127
ZINC2372127

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.