Vitas-M small molecule compound
(2E)-N-benzyl-2-{3-[2-(4-cyclohexylphenoxy)ethoxy]benzylidene}hydrazinecarbothioamide
Catalog ID
STK038217
SMILES S=C(NCc1ccccc1)N/N=C/c1cccc(c1)OCCOc1ccc(cc1)C1CCCCC1
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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 C29H33N3O2S MW 487.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O2S/c35-29(30-21-23-8-3-1-4-9-23)32-31-22-24-10-7-13-28(20-24)34-19-18-33-27-16-14-26(15-17-27)25-11-5-2-6-12-25/h1,3-4,7-10,13-17,20,22,25H,2,5-6,11-12,18-19,21H2,(H2,30,32,35)/b31-22+InChIKey
ZJNQXDGYTDWINH-DFKUXCBWSA-NSynonyms
(2E)NBENZYL2(3(2(4CYCLOHEXYLPHENOXY)ETHOXY)BENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
1benzyl3((E)(3(2(4cyclohexylphenoxy)ethoxy)phenyl)methylideneamino)thiourea
C1CCC(CC1)C2=CC=C(C=C2)OCCOC3=CC=CC(=C3)C=NNC(=S)NCC4=CC=CC=C4
InChI=1SC29H33N3O2Sc3529(3021238314923)323122241071328(2024)3419183327161426(151727)25115261225h1347101317202225H2561112181921H2(H2303235)b3122+
MFCD02207098
S=C(NCc1ccccc1)NN=Cc1cccc(c1)OCCOc1ccc(cc1)C1CCCCC1
STK038217
ZINC000013942215
ZINC33581437
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