Vitas-M small molecule compound
5-chloro-N-{2-[(4-methylphenyl)carbonyl]-1-benzofuran-3-yl}-2-(methylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK515812
SMILES CSc1ncc(c(n1)C(=O)Nc1c(oc2c1cccc2)C(=O)c1ccc(cc1)C)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 C22H16ClN3O3S MW 437.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S/c1-12-7-9-13(10-8-12)19(27)20-17(14-5-3-4-6-16(14)29-20)25-21(28)18-15(23)11-24-22(26-18)30-2/h3-11H,1-2H3,(H,25,28)InChIKey
JHWQGNZAZVDGLT-UHFFFAOYSA-NSynonyms
5chloroN(2((4methylphenyl)carbonyl)1benzofuran3yl)2(methylsulfanyl)pyrimidine4carboxamide
5chloroN(2(4methylbenzoyl)1benzofuran3yl)2methylsulfanylpyrimidine4carboxamide
CC1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SC
InChI=1SC22H16ClN3O3Sc1127913(10812)19(27)2017(14534616(14)2920)2521(28)1815(23)112422(2618)302h311H12H3(H2528)
MFCD06645392
ZINC000008612019
ZINC08612019
ZINC8612019
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