Vitas-M small molecule compound

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

Catalog ID
STK528660
SMILES CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCCC

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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 C25H35N3O2S MW 441.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35N3O2S/c1-3-5-6-7-8-18-30-24-15-11-22(12-16-24)20-27-28-25(31)26-19-21-9-13-23(14-10-21)29-17-4-2/h9-16,20H,3-8,17-19H2,1-2H3,(H2,26,28,31)/b27-20+
InChIKey
KOTPUIPFXYWVOF-NHFJDJAPSA-N
Synonyms
207290-52-6
(2E)2(4(heptyloxy)benzylidene)N(4propoxybenzyl)hydrazinecarbothioamide
(E)2(4(heptyloxy)benzylidene)N(4propoxybenzyl)hydrazinecarbothioamide
1((E)(4heptoxyphenyl)methylideneamino)3((4propoxyphenyl)methyl)thiourea
207290526
CCCCCCCOC1=CC=C(C=C1)C=NNC(=S)NCC2=CC=C(C=C2)OCCC
CCCCCCCOc1ccc(cc1)C=NNC(=S)NCc1ccc(cc1)OCCC
InChI=1SC25H35N3O2Sc135678183024151122(121624)20272825(31)26192191323(141021)291742h91620H381719H212H3(H2262831)b2720+
MFCD00330640
ZINC000100688221
ZINC102405144

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Available files

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