Vitas-M small molecule compound
(4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(4-methoxyphenyl)-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Catalog ID
STL051220
SMILES COc1ccc(cc1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/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 C34H27N3O5S2 MW 621.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27N3O5S2/c1-19-16-24-17-22(12-15-27(24)42-19)30(38)28-29(21-10-13-25(41-2)14-11-21)37(32(40)31(28)39)33-35-36-34(44-33)43-18-23-8-5-7-20-6-3-4-9-26(20)23/h3-15,17,19,29,38H,16,18H2,1-2H3/b30-28+InChIKey
XRNRSNMWIIYLNP-SJCQXOIGSA-NSynonyms
893695-98-2(4E)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(4methoxyphenyl)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)pyrrolidine23dione
(4E)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(4METHOXYPHENYL)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)PYRROLIDINE23DIONE
893695982
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)SCC5=CC=CC6=CC=CC=C65)C7=CC=C(C=C7)OC)O
COc1ccc(cc1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC34H27N3O5S2c11916241722(121527(24)4219)30(38)2829(21101325(412)141121)37(32(40)31(28)39)33353634(4433)43182385720634926(20)23h31517192938H1618H212H3b3028+
MFCD05733580
ZINC000102888402
ZINC000102888412
Check stock
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Check stock on Vitas-MAvailable files
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