Vitas-M small molecule compound
2-({2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5,6-dimethyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL003850
SMILES OCCN1CCN(CC1)C(=O)CSc1nc2sc(c(c2c(=O)n1CC=C)C)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 C19H26N4O3S2 MW 422.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O3S2/c1-4-5-23-18(26)16-13(2)14(3)28-17(16)20-19(23)27-12-15(25)22-8-6-21(7-9-22)10-11-24/h4,24H,1,5-12H2,2-3H3InChIKey
YFGZNGQQPAFVQC-UHFFFAOYSA-NSynonyms
325693-32-12((2(4(2hydroxyethyl)piperazin1yl)2oxoethyl)sulfanyl)56dimethyl3(prop2en1yl)thieno(23d)pyrimidin4(3H)one
2(2(4(2HYDROXYETHYL)PIPERAZIN1YL)2OXOETHYL)SULFANYL56DIMETHYL3PROP2ENYLTHIENO(23D)PYRIMIDIN4ONE
2(2(4(2HYDROXYETHYL)PIPERAZINYL)2OXOETHYLTHIO)56DIMETHYL3PROP2ENYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE
325693321
3ALLYL2((2(4(2HYDROXYETHYL)PIPERAZIN1YL)2OXOETHYL)THIO)56DIMETHYLTHIENO(23D)PYRIMIDIN4(3H)ONE
CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)CCO)CC=C)C
InChI=1SC19H26N4O3S2c1452318(26)1613(2)14(3)2817(16)2019(23)271215(25)228621(7922)101124h424H1512H223H3
MFCD01960388
ZINC000019791482
ZINC19791482
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