Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK704404
SMILES O=C1C(=C(C(N1c1nnc(s1)SCc1cccc2c1cccc2)c1ccccc1)C(=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 C32H21N3O4S2 MW 575.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H21N3O4S2/c36-28(25-17-21-12-5-7-16-24(21)39-25)26-27(20-10-2-1-3-11-20)35(30(38)29(26)37)31-33-34-32(41-31)40-18-22-14-8-13-19-9-4-6-15-23(19)22/h1-17,27,37H,18H2InChIKey
ULECHWDGEWYFGS-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)4HYDROXY1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)2PHENYL2HPYRROL5ONE
4(1BENZOFURAN2YLCARBONYL)3HYDROXY1(5((1NAPHTHYLMETHYL)SULFANYL)134THIADIAZOL2YL)5PHENYL15DIHYDRO2HPYRROL2ONE
4(1benzofuran2ylcarbonyl)3hydroxy1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)5phenyl15dihydro2Hpyrrol2one
C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54)O)C(=O)C6=CC7=CC=CC=C7O6
InChI=1SC32H21N3O4S2c3628(25172112571624(21)3925)2627(20102131120)35(30(38)29(26)37)31333432(4131)40182214813199461523(19)22h1172737H18H2
MFCD04088622
ZINC000008383382
ZINC000008383384
ZINC08383382
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