Vitas-M small molecule compound
2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL349297
SMILES O=C(N1CCCC1)CSc1nc(nc2c1c1CCCCc1s2)n1nc(cc1C)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 C21H25N5OS2 MW 427.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5OS2/c1-13-11-14(2)26(24-13)21-22-19(28-12-17(27)25-9-5-6-10-25)18-15-7-3-4-8-16(15)29-20(18)23-21/h11H,3-10,12H2,1-2H3InChIKey
CYOPLQABVCARIV-UHFFFAOYSA-NSynonyms
908230-56-82((2(35dimethyl1Hpyrazol1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4yl)sulfanyl)1(pyrrolidin1yl)ethanone
2((2(35dimethyl1Hpyrazol1yl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)thio)1(pyrrolidin1yl)ethanone
2((2(35dimethylpyrazol1yl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)sulfanyl)1pyrrolidin1ylethanone
908230568
CC1=CC(=NN1C2=NC3=C(C4=C(S3)CCCC4)C(=N2)SCC(=O)N5CCCC5)C
InChI=1SC21H25N5OS2c1131114(2)26(2413)212219(281217(27)259561025)1815734816(15)2920(18)2321h11H31012H212H3
MFCD05703596
ZINC000004295239
ZINC04295239
ZINC4295239
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