Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(4-ethylphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK705251
SMILES CCc1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)O
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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 C30H22ClN3O4S2 MW 588.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22ClN3O4S2/c1-2-17-7-11-19(12-8-17)25-24(26(35)23-15-20-5-3-4-6-22(20)38-23)27(36)28(37)34(25)29-32-33-30(40-29)39-16-18-9-13-21(31)14-10-18/h3-15,25,36H,2,16H2,1H3InChIKey
IAWGWGDLNACLOJ-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)1(5((4CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)2(4ETHYLPHENYL)4HYDROXY2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(5((4chlorobenzyl)sulfanyl)134thiadiazol2yl)5(4ethylphenyl)3hydroxy15dihydro2Hpyrrol2one
CCC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=C(C=C4)Cl)O)C(=O)C5=CC6=CC=CC=C6O5
InChI=1SC30H22ClN3O4S2c121771119(12817)2524(26(35)231520534622(20)3823)27(36)28(37)34(25)29323330(4029)39161891321(31)141018h3152536H216H21H3
MFCD04088625
ZINC000008383419
ZINC000008383425
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