Vitas-M small molecule compound
5-[3-(benzyloxy)phenyl]-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK905128
SMILES CC1Oc2c(C1)cc(cc2)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)OCc1ccccc1)c1nnc(s1)SCc1ccc(cc1)C
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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 C37H31N3O5S2 MW 661.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H31N3O5S2/c1-22-11-13-25(14-12-22)21-46-37-39-38-36(47-37)40-32(26-9-6-10-29(19-26)44-20-24-7-4-3-5-8-24)31(34(42)35(40)43)33(41)27-15-16-30-28(18-27)17-23(2)45-30/h3-16,18-19,23,32,42H,17,20-21H2,1-2H3InChIKey
DZENTNQWFCVRFB-UHFFFAOYSA-NSynonyms
5(3(benzyloxy)phenyl)3hydroxy1(5((4methylbenzyl)sulfanyl)134thiadiazol2yl)4((2methyl23dihydro1benzofuran5yl)carbonyl)15dihydro2Hpyrrol2one
5(3(benzyloxy)phenyl)3hydroxy4(2methyl23dihydrobenzofuran5carbonyl)1(5((4methylbenzyl)thio)134thiadiazol2yl)1Hpyrrol2(5H)one
MFCD18065222
ZINC000097967307
ZINC000097967310
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