Vitas-M small molecule compound
N'-[(E)-{4-[(2-cyanobenzyl)oxy]-3-methoxyphenyl}methylidene]-2-({5-[3-(4-methoxyphenyl)propyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetohydrazide
Catalog ID
STK325520
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(o2)CCCc2ccc(cc2)OC)ccc1OCc1ccccc1C#N
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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 C30H29N5O5S MW 571.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O5S/c1-37-25-13-10-21(11-14-25)6-5-9-29-34-35-30(40-29)41-20-28(36)33-32-18-22-12-15-26(27(16-22)38-2)39-19-24-8-4-3-7-23(24)17-31/h3-4,7-8,10-16,18H,5-6,9,19-20H2,1-2H3,(H,33,36)/b32-18+InChIKey
ZIAZDGYUCIZAPY-KCSSXMTESA-NSynonyms
COC1=CC=C(C=C1)CCCC2=NN=C(O2)SCC(=O)NN=CC3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)OC
COc1cc(C=NNC(=O)CSc2nnc(o2)CCCc2ccc(cc2)OC)ccc1OCc1ccccc1C#N
InChI=1SC30H29N5O5Sc13725131021(111425)65929343530(4029)412028(36)33321822121526(27(1622)382)391924843723(24)1731h3478101618H5691920H212H3(H3336)b3218+
MFCD05040564
N((E)(4((2cyanobenzyl)oxy)3methoxyphenyl)methylidene)2((5(3(4methoxyphenyl)propyl)134oxadiazol2yl)sulfanyl)acetohydrazide
N((E)(4((2cyanophenyl)methoxy)3methoxyphenyl)methylideneamino)2((5(3(4methoxyphenyl)propyl)134oxadiazol2yl)sulfanyl)acetamide
ZINC000097962514
ZINC101957138
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