Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-2-[3-(2-methoxyphenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL077303
SMILES COc1ccccc1n1c(=O)n(CC(=O)Nc2ccc(c(c2)Cl)C)c2c(c1=O)scc2
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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 C22H18ClN3O4S MW 455.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O4S/c1-13-7-8-14(11-15(13)23)24-19(27)12-25-17-9-10-31-20(17)21(28)26(22(25)29)16-5-3-4-6-18(16)30-2/h3-11H,12H2,1-2H3,(H,24,27)InChIKey
MXUWPUMTRTXRLD-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)C4=CC=CC=C4OC)SC=C3)Cl
InChI=1SC22H18ClN3O4Sc1137814(1115(13)23)2419(27)1225179103120(17)21(28)26(22(25)29)16534618(16)302h311H12H212H3(H2427)
MFCD18198530
N(3chloro4methylphenyl)2(3(2methoxyphenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
N(3chloro4methylphenyl)2(3(2methoxyphenyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057490678
ZINC57490678
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