Vitas-M small molecule compound
methyl 4-chloro-2-({[3-(2-methylpropyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetyl}amino)benzoate
Catalog ID
STL073908
SMILES COC(=O)c1ccc(cc1NC(=O)Cn1c(=O)n(CC(C)C)c(=O)c2c1ccs2)Cl
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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 C20H20ClN3O5S MW 449.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3O5S/c1-11(2)9-24-18(26)17-15(6-7-30-17)23(20(24)28)10-16(25)22-14-8-12(21)4-5-13(14)19(27)29-3/h4-8,11H,9-10H2,1-3H3,(H,22,25)InChIKey
WPVITJJQCLEMFR-UHFFFAOYSA-NSynonyms
1260949-97-01260949970
CC(C)CN1C(=O)C2=C(C=CS2)N(C1=O)CC(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC
InChI=1SC20H20ClN3O5Sc111(2)92418(26)1715(673017)23(20(24)28)1016(25)2214812(21)4513(14)19(27)293h4811H910H213H3(H2225)
methyl4chloro2(((3(2methylpropyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetyl)amino)benzoate
methyl4chloro2((2(3(2methylpropyl)24dioxothieno(32d)pyrimidin1yl)acetyl)amino)benzoate
MFCD18195352
ZINC000057486108
ZINC57486108
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