Vitas-M small molecule compound
methyl 4-[7-chloro-2-(5-methyl-1,3,4-thiadiazol-2-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Catalog ID
STL343620
SMILES COC(=O)c1ccc(cc1)C1N(c2nnc(s2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)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 C22H14ClN3O5S MW 467.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14ClN3O5S/c1-10-24-25-22(32-10)26-17(11-3-5-12(6-4-11)21(29)30-2)16-18(27)14-9-13(23)7-8-15(14)31-19(16)20(26)28/h3-9,17H,1-2H3InChIKey
UUJUQQKZUIOFRD-UHFFFAOYSA-NSynonyms
630086-76-9630086769
CC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Cl)C5=CC=C(C=C5)C(=O)OC
InChI=1SC22H14ClN3O5Sc110242522(3210)2617(113512(6411)21(29)302)1618(27)14913(23)7815(14)3119(16)20(26)28h3917H12H3
methyl4(7chloro2(5methyl134thiadiazol2yl)39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
METHYL4(7CHLORO2(5METHYL134THIADIAZOL2YL)39DIOXO1HCHROMENO(23C)PYRROL1YL)BENZOATE
MFCD04168013
ZINC000002415679
ZINC000002415680
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