Vitas-M small molecule compound
(2E)-2-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}-3-methoxybenzylidene)hydrazinecarbothioamide
Catalog ID
STK066535
SMILES CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)/C=N/NC(=S)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 C23H31N3O4S MW 445.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O4S/c1-3-4-5-6-13-28-19-8-10-20(11-9-19)29-14-15-30-21-12-7-18(16-22(21)27-2)17-25-26-23(24)31/h7-12,16-17H,3-6,13-15H2,1-2H3,(H3,24,26,31)/b25-17+InChIKey
XOJPDSLWJHLNES-KOEQRZSOSA-NSynonyms
((E)(4(2(4hexoxyphenoxy)ethoxy)3methoxyphenyl)methylideneamino)thiourea
(2E)2(4(2(4(HEXYLOXY)PHENOXY)ETHOXY)3METHOXYBENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=NNC(=S)N)OC
CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)C=NNC(=S)N
InChI=1SC23H31N3O4Sc1345613281981020(11919)291415302112718(1622(21)272)17252623(24)31h7121617H361315H212H3(H3242631)b2517+
MFCD02204243
STK066535
ZINC000009553923
ZINC33603109
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