Vitas-M small molecule compound
N-(2-chloro-6-methylphenyl)-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL029676
SMILES O=C(Nc1c(C)cccc1Cl)CSc1nc2ccsc2c(=O)n1CC(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 C19H20ClN3O2S2 MW 421.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3O2S2/c1-11(2)9-23-18(25)17-14(7-8-26-17)21-19(23)27-10-15(24)22-16-12(3)5-4-6-13(16)20/h4-8,11H,9-10H2,1-3H3,(H,22,24)InChIKey
MBDLLZKKDBVBET-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)Cl)NC(=O)CSC2=NC3=C(C(=O)N2CC(C)C)SC=C3
InChI=1SC19H20ClN3O2S2c111(2)92318(25)1714(782617)2119(23)271015(24)221612(3)54613(16)20h4811H910H213H3(H2224)
MFCD18189966
N(2chloro6methylphenyl)2((3(2methylpropyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(2chloro6methylphenyl)2(3(2methylpropyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000057426286
ZINC57426286
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