Vitas-M small molecule compound
4-[(4-butoxyphenyl)carbonyl]-5-[4-(heptyloxy)-3-methoxyphenyl]-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK816369
SMILES CCCCCCCOc1ccc(cc1OC)C1C(=C(C(=O)N1c1nnc(s1)SCc1ccc(cc1)C)O)C(=O)c1ccc(cc1)OCCCC
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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 C39H45N3O6S2 MW 715.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H45N3O6S2/c1-5-7-9-10-11-23-48-31-21-18-29(24-32(31)46-4)34-33(35(43)28-16-19-30(20-17-28)47-22-8-6-2)36(44)37(45)42(34)38-40-41-39(50-38)49-25-27-14-12-26(3)13-15-27/h12-21,24,34,44H,5-11,22-23,25H2,1-4H3InChIKey
ABUIDBDXTIJAEZ-UHFFFAOYSA-NSynonyms
4((4butoxyphenyl)carbonyl)5(4(heptyloxy)3methoxyphenyl)3hydroxy1(5((4methylbenzyl)sulfanyl)134thiadiazol2yl)15dihydro2Hpyrrol2one
MFCD06642710
ZINC000098047595
ZINC000098047596
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