Vitas-M small molecule compound
2-{[3-(3,4-dimethylbenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(tetrahydrofuran-2-ylmethyl)acetamide
Catalog ID
STL029725
SMILES O=C(CSc1nc2ccsc2c(=O)n1Cc1ccc(c(c1)C)C)NCC1CCCO1
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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 C22H25N3O3S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S2/c1-14-5-6-16(10-15(14)2)12-25-21(27)20-18(7-9-29-20)24-22(25)30-13-19(26)23-11-17-4-3-8-28-17/h5-7,9-10,17H,3-4,8,11-13H2,1-2H3,(H,23,26)InChIKey
TXLZLJWQUMSVBK-UHFFFAOYSA-NSynonyms
2((3(34dimethylbenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)N(tetrahydrofuran2ylmethyl)acetamide
2(3((34dimethylphenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylN(oxolan2ylmethyl)acetamide
CC1=C(C=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NCC4CCCO4)C
InChI=1SC22H25N3O3S2c1145616(1015(14)2)122521(27)2018(792920)2422(25)301319(26)2311174382817h5791017H3481113H212H3(H2326)
MFCD18190015
ZINC000057426332
ZINC000057426333
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