Vitas-M small molecule compound
1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[(4-butoxyphenyl)carbonyl]-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK814790
SMILES CCCCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nnc(s1)SCc1ccccc1
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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 C33H33N3O4S2 MW 599.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O4S2/c1-4-5-19-40-26-17-15-25(16-18-26)29(37)27-28(24-13-11-23(12-14-24)21(2)3)36(31(39)30(27)38)32-34-35-33(42-32)41-20-22-9-7-6-8-10-22/h6-18,21,28,38H,4-5,19-20H2,1-3H3InChIKey
HXMPTFVDWYGAFX-UHFFFAOYSA-NSynonyms
1(5(benzylsulfanyl)134thiadiazol2yl)4((4butoxyphenyl)carbonyl)3hydroxy5(4(propan2yl)phenyl)15dihydro2Hpyrrol2one
MFCD04442315
ZINC000098046452
ZINC000098046453
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