Vitas-M small molecule compound
N-(2-chloro-4-methylphenyl)-2-[(3-ethyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL084409
SMILES CCn1c(SCC(=O)Nc2ccc(cc2Cl)C)nc2c(c1=O)[nH]c(c2)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 C18H19ClN4O2S MW 390.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN4O2S/c1-4-23-17(25)16-14(8-11(3)20-16)22-18(23)26-9-15(24)21-13-6-5-10(2)7-12(13)19/h5-8,20H,4,9H2,1-3H3,(H,21,24)InChIKey
OXVGFJXSSQTGTL-UHFFFAOYSA-NSynonyms
CCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NC3=C(C=C(C=C3)C)Cl
CCn1c(SCC(=O)Nc2ccc(cc2Cl)C)nc2c(c1=O)(nH)c(c2)C
InChI=1SC18H19ClN4O2Sc142317(25)1614(811(3)2016)2218(23)26915(24)21136510(2)712(13)19h5820H49H213H3(H2124)
MFCD18202979
N(2chloro4methylphenyl)2((3ethyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(2chloro4methylphenyl)2((3ethyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000057521890
ZINC57521890
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