Vitas-M small molecule compound

(2E)-2-[4-(heptyloxy)benzylidene]-N-[4-(2-methylpropoxy)benzyl]hydrazinecarbothioamide

Catalog ID
STK528039
SMILES CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCC(C)C

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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 C26H37N3O2S MW 455.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H37N3O2S/c1-4-5-6-7-8-17-30-24-13-11-23(12-14-24)19-28-29-26(32)27-18-22-9-15-25(16-10-22)31-20-21(2)3/h9-16,19,21H,4-8,17-18,20H2,1-3H3,(H2,27,29,32)/b28-19+
InChIKey
RIKOXVIDTFNMTR-TURZUDJPSA-N
Synonyms
207290-55-9
(((1E)2(4HEPTYLOXYPHENYL)1AZAVINYL)AMINO)(((4(2METHYLPROPOXY)PHENYL)METHYL)AMINO)METHANE1THIONE
(2E)2(4(heptyloxy)benzylidene)N(4(2methylpropoxy)benzyl)hydrazinecarbothioamide
(E)2(4(heptyloxy)benzylidene)N(4isobutoxybenzyl)hydrazinecarbothioamide
1((E)(4heptoxyphenyl)methylideneamino)3((4(2methylpropoxy)phenyl)methyl)thiourea
207290559
4(HEPTYLOXY)BENZALDEHYDEN(4ISOBUTOXYBENZYL)THIOSEMICARBAZONE
CCCCCCCOC1=CC=C(C=C1)C=NNC(=S)NCC2=CC=C(C=C2)OCC(C)C
CCCCCCCOc1ccc(cc1)C=NNC(=S)NCc1ccc(cc1)OCC(C)C
InChI=1SC26H37N3O2Sc145678173024131123(121424)19282926(32)27182291525(161022)312021(2)3h9161921H48171820H213H3(H2272932)b2819+
MFCD00571302
ZINC000008427507
ZINC102404200

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.