Vitas-M small molecule compound
(2E)-N-benzyl-2-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}hydrazinecarbothioamide
Catalog ID
STK088409
SMILES CCOc1cc(/C=N/NC(=S)NCc2ccccc2)cc(c1OCCOc1ccc(c(c1)C)C)Cl
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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 C27H30ClN3O3S MW 512.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClN3O3S/c1-4-32-25-16-22(18-30-31-27(35)29-17-21-8-6-5-7-9-21)15-24(28)26(25)34-13-12-33-23-11-10-19(2)20(3)14-23/h5-11,14-16,18H,4,12-13,17H2,1-3H3,(H2,29,31,35)/b30-18+InChIKey
QQRPOJZYKBYWDJ-UXHLAJHPSA-NSynonyms
381714-54-1(2E)NBENZYL2(3CHLORO4(2(34DIMETHYLPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
(E)Nbenzyl2(3chloro4(2(34dimethylphenoxy)ethoxy)5ethoxybenzylidene)hydrazinecarbothioamide
1benzyl3((E)(3chloro4(2(34dimethylphenoxy)ethoxy)5ethoxyphenyl)methylideneamino)thiourea
381714541
CCOC1=C(C(=CC(=C1)C=NNC(=S)NCC2=CC=CC=C2)Cl)OCCOC3=CC(=C(C=C3)C)C
CCOc1cc(C=NNC(=S)NCc2ccccc2)cc(c1OCCOc1ccc(c(c1)C)C)Cl
InChI=1SC27H30ClN3O3Sc1432251622(18303127(35)2917218657921)1524(28)26(25)3413123323111019(2)20(3)1423h511141618H4121317H213H3(H2293135)b3018+
MFCD02998677
STK088409
ZINC000009724212
ZINC33535607
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