Vitas-M small molecule compound
5-chloro-N-{2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl}-2-(prop-2-en-1-ylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK911687
SMILES C=CCSc1ncc(c(n1)C(=O)Nc1c(oc2c1cccc2)C(=O)Nc1ccc(cc1)OC)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 C24H19ClN4O4S MW 494.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4O4S/c1-3-12-34-24-26-13-17(25)20(29-24)22(30)28-19-16-6-4-5-7-18(16)33-21(19)23(31)27-14-8-10-15(32-2)11-9-14/h3-11,13H,1,12H2,2H3,(H,27,31)(H,28,30)InChIKey
KOOKKYIIJQEJBR-UHFFFAOYSA-NSynonyms
5chloroN(2((4methoxyphenyl)carbamoyl)1benzofuran3yl)2(prop2en1ylsulfanyl)pyrimidine4carboxamide
5chloroN(2((4methoxyphenyl)carbamoyl)1benzofuran3yl)2prop2enylsulfanylpyrimidine4carboxamide
COC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)C4=NC(=NC=C4Cl)SCC=C
InChI=1SC24H19ClN4O4Sc13123424261317(25)20(2924)22(30)281916645718(16)3321(19)23(31)271481015(322)11914h31113H112H22H3(H2731)(H2830)
MFCD07426616
ZINC000008916162
ZINC08916162
ZINC8916162
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