Vitas-M small molecule compound
methyl 5-chloro-2-({[2-(methylsulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetyl}amino)benzoate
Catalog ID
STL079339
SMILES COC(=O)c1cc(Cl)ccc1NC(=O)Cn1c(SC)nc2c(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 C17H14ClN3O4S2 MW 423.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O4S2/c1-25-16(24)10-7-9(18)3-4-11(10)19-13(22)8-21-15(23)14-12(5-6-27-14)20-17(21)26-2/h3-7H,8H2,1-2H3,(H,19,22)InChIKey
UNRRWQPLGBOPSG-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CC(=C1)Cl)NC(=O)CN2C(=O)C3=C(C=CS3)N=C2SC
InChI=1SC17H14ClN3O4S2c12516(24)1079(18)3411(10)1913(22)82115(23)1412(562714)2017(21)262h37H8H212H3(H1922)
methyl5chloro2(((2(methylsulfanyl)4oxothieno(32d)pyrimidin3(4H)yl)acetyl)amino)benzoate
methyl5chloro2((2(2methylsulfanyl4oxothieno(32d)pyrimidin3yl)acetyl)amino)benzoate
MFCD18200541
ZINC000057505208
ZINC57505208
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