Vitas-M small molecule compound
4-(1-benzofuran-2-ylcarbonyl)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-hydroxy-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK800677
SMILES O=C(C1=C(O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)c1nnc(s1)SCc1ccccc1)c1oc2c(c1)cccc2
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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 C34H23N3O5S2 MW 617.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H23N3O5S2/c38-30(27-19-22-12-7-8-17-26(22)42-27)28-29(23-13-9-16-25(18-23)41-24-14-5-2-6-15-24)37(32(40)31(28)39)33-35-36-34(44-33)43-20-21-10-3-1-4-11-21/h1-19,29,39H,20H2InChIKey
MUJFCCUJMRIPPP-UHFFFAOYSA-NSynonyms
3(1BENZOFURAN2CARBONYL)1(5BENZYLSULFANYL134THIADIAZOL2YL)4HYDROXY2(3PHENOXYPHENYL)2HPYRROL5ONE
4(1benzofuran2ylcarbonyl)1(5(benzylsulfanyl)134thiadiazol2yl)3hydroxy5(3phenoxyphenyl)15dihydro2Hpyrrol2one
C1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=CC=CC=C5O4)C6=CC(=CC=C6)OC7=CC=CC=C7
InChI=1SC34H23N3O5S2c3830(27192212781726(22)4227)2829(231391625(1823)4124145261524)37(32(40)31(28)39)33353634(4433)432021103141121h1192939H20H2
MFCD04147951
ZINC000008441225
ZINC000008441226
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